[4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate

C363H290N2O73 — CID 162154912

IUPAC[4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate
SMILESC=C(C)C(=O)Nc1ccc(OC(=O)c2ccc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4ccc(C(=O)Oc5ccc(NC(=O)C(=C)C)cc5)cc4)ccc4ccccc34)cc2)cc1.C=CC(=O)OCCCCOc1ccc(/C=C/C(=O)Cc2ccc3cc(/C=C/C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)/C=C/c5ccc6cc(OC(=O)/C=C/c7ccc(OCCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C/C(=O)Oc3ccc(/C=C/C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)/C=C/c5ccc(OC(=O)/C=C/c6ccc(OC(=O)/C=C/c7ccc(OCCCCOC(=O)C=C)cc7)cc6)cc5)ccc5ccccc45)cc3)cc2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2c(OC)cc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4cc(OC)c(OC(=O)c5ccc(OCCCCOC(=O)C=C)cc5)c(OC)c4)ccc4ccccc34)cc2OC)cc1.C=CC(=O)OCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4ccc(OC(=O)/C=C/c5ccc(OCCOC(=O)C=C)cc5)cc4)ccc4ccccc34)cc2)cc1
InChIInChI=1S/C88H70O18.C79H64O13.C70H62O18.C66H50O14.C60H44N2O10/c1-3-79(89)99-59-11-9-57-97-69-37-17-61(18-38-69)29-51-81(91)101-71-41-21-63(22-42-71)31-53-83(93)103-73-45-25-65(26-46-73)33-55-85(95)105-77-49-35-67-13-5-7-15-75(67)87(77)88-76-16-8-6-14-68(76)36-50-78(88)106-86(96)56-34-66-27-47-74(48-28-66)104-84(94)54-32-64-23-43-72(44-24-64)102-82(92)52-30-62-19-39-70(40-20-62)98-58-10-12-60-100-80(90)4-2;1-3-73(81)88-47-11-9-45-86-66-35-21-54(22-36-66)20-34-65(80)52-58-19-30-61-49-56(17-28-62(61)51-58)26-43-76(84)91-71-40-32-59-13-5-7-15-69(59)78(71)79-70-16-8-6-14-60(70)33-41-72(79)92-77(85)44-27-57-18-29-64-53-68(39-31-63(64)50-57)90-75(83)42-25-55-23-37-67(38-24-55)87-46-10-12-48-89-74(82)4-2;1-7-61(71)83-39-15-13-37-81-51-29-23-49(24-30-51)69(75)87-67-57(77-3)41-45(42-58(67)78-4)21-35-63(73)85-55-33-27-47-17-9-11-19-53(47)65(55)66-54-20-12-10-18-48(54)28-34-56(66)86-64(74)36-22-46-43-59(79-5)68(60(44-46)80-6)88-70(76)50-25-31-52(32-26-50)82-38-14-16-40-84-62(72)8-2;1-3-59(67)75-43-41-73-51-27-13-45(14-28-51)21-37-61(69)77-53-31-17-47(18-32-53)23-39-63(71)79-57-35-25-49-9-5-7-11-55(49)65(57)66-56-12-8-6-10-50(56)26-36-58(66)80-64(72)40-24-48-19-33-54(34-20-48)78-62(70)38-22-46-15-29-52(30-16-46)74-42-44-76-60(68)4-2;1-37(2)57(65)61-45-25-29-47(30-26-45)69-59(67)43-19-13-39(14-20-43)17-35-53(63)71-51-33-23-41-9-5-7-11-49(41)55(51)56-50-12-8-6-10-42(50)24-34-52(56)72-54(64)36-18-40-15-21-44(22-16-40)60(68)70-48-31-27-46(28-32-48)62-58(66)38(3)4/h3-8,13-56H,1-2,9-12,57-60H2;3-8,13-44,49-51,53H,1-2,9-12,45-48,52H2;7-12,17-36,41-44H,1-2,13-16,37-40H2,3-6H3;3-40H,1-2,41-44H2;5-36H,1,3H2,2,4H3,(H,61,65)(H,62,66)/b51-29+,52-30+,53-31+,54-32+,55-33+,56-34+;34-20+,42-25+,43-26+,44-27+;35-21+,36-22+;37-21+,38-22+,39-23+,40-24+;35-17+,36-18+
InChIKeyZLRRHRBIEWTKDF-IQOPMXSHSA-N
MW5848.25 g/mol
LogP71.44
Rot. Bonds128

About [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate

[4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate (PubChem CID 162154912) has the molecular formula C363H290N2O73 and a molecular weight of 5848.25 g/mol. Its IUPAC name is [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate.

Molecular Properties

Compound Name[4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate
PubChem CID162154912
Molecular FormulaC363H290N2O73
Molecular Weight5848.25 g/mol
Exact Mass5843.90
IUPAC Name[4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate
SMILESC=C(C)C(=O)Nc1ccc(OC(=O)c2ccc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4ccc(C(=O)Oc5ccc(NC(=O)C(=C)C)cc5)cc4)ccc4ccccc34)cc2)cc1.C=CC(=O)OCCCCOc1ccc(/C=C/C(=O)Cc2ccc3cc(/C=C/C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)/C=C/c5ccc6cc(OC(=O)/C=C/c7ccc(OCCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C/C(=O)Oc3ccc(/C=C/C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)/C=C/c5ccc(OC(=O)/C=C/c6ccc(OC(=O)/C=C/c7ccc(OCCCCOC(=O)C=C)cc7)cc6)cc5)ccc5ccccc45)cc3)cc2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2c(OC)cc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4cc(OC)c(OC(=O)c5ccc(OCCCCOC(=O)C=C)cc5)c(OC)c4)ccc4ccccc34)cc2OC)cc1.C=CC(=O)OCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4ccc(OC(=O)/C=C/c5ccc(OCCOC(=O)C=C)cc5)cc4)ccc4ccccc34)cc2)cc1
InChIInChI=1S/C88H70O18.C79H64O13.C70H62O18.C66H50O14.C60H44N2O10/c1-3-79(89)99-59-11-9-57-97-69-37-17-61(18-38-69)29-51-81(91)101-71-41-21-63(22-42-71)31-53-83(93)103-73-45-25-65(26-46-73)33-55-85(95)105-77-49-35-67-13-5-7-15-75(67)87(77)88-76-16-8-6-14-68(76)36-50-78(88)106-86(96)56-34-66-27-47-74(48-28-66)104-84(94)54-32-64-23-43-72(44-24-64)102-82(92)52-30-62-19-39-70(40-20-62)98-58-10-12-60-100-80(90)4-2;1-3-73(81)88-47-11-9-45-86-66-35-21-54(22-36-66)20-34-65(80)52-58-19-30-61-49-56(17-28-62(61)51-58)26-43-76(84)91-71-40-32-59-13-5-7-15-69(59)78(71)79-70-16-8-6-14-60(70)33-41-72(79)92-77(85)44-27-57-18-29-64-53-68(39-31-63(64)50-57)90-75(83)42-25-55-23-37-67(38-24-55)87-46-10-12-48-89-74(82)4-2;1-7-61(71)83-39-15-13-37-81-51-29-23-49(24-30-51)69(75)87-67-57(77-3)41-45(42-58(67)78-4)21-35-63(73)85-55-33-27-47-17-9-11-19-53(47)65(55)66-54-20-12-10-18-48(54)28-34-56(66)86-64(74)36-22-46-43-59(79-5)68(60(44-46)80-6)88-70(76)50-25-31-52(32-26-50)82-38-14-16-40-84-62(72)8-2;1-3-59(67)75-43-41-73-51-27-13-45(14-28-51)21-37-61(69)77-53-31-17-47(18-32-53)23-39-63(71)79-57-35-25-49-9-5-7-11-55(49)65(57)66-56-12-8-6-10-50(56)26-36-58(66)80-64(72)40-24-48-19-33-54(34-20-48)78-62(70)38-22-46-15-29-52(30-16-46)74-42-44-76-60(68)4-2;1-37(2)57(65)61-45-25-29-47(30-26-45)69-59(67)43-19-13-39(14-20-43)17-35-53(63)71-51-33-23-41-9-5-7-11-49(41)55(51)56-50-12-8-6-10-42(50)24-34-52(56)72-54(64)36-18-40-15-21-44(22-16-40)60(68)70-48-31-27-46(28-32-48)62-58(66)38(3)4/h3-8,13-56H,1-2,9-12,57-60H2;3-8,13-44,49-51,53H,1-2,9-12,45-48,52H2;7-12,17-36,41-44H,1-2,13-16,37-40H2,3-6H3;3-40H,1-2,41-44H2;5-36H,1,3H2,2,4H3,(H,61,65)(H,62,66)/b51-29+,52-30+,53-31+,54-32+,55-33+,56-34+;34-20+,42-25+,43-26+,44-27+;35-21+,36-22+;37-21+,38-22+,39-23+,40-24+;35-17+,36-18+
InChIKeyZLRRHRBIEWTKDF-IQOPMXSHSA-N
XLogP71.44
TPSA948.73 Ų
H-Bond Donors2
H-Bond Acceptors73
Rotatable Bonds128
Heavy Atoms438
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005848.25
LogP ≤ 571.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1073

Analyze [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate with MolForge

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Related Compounds

[4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-(4-phenylphenyl)prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-(4-phenylphenyl)prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] 4-(2-prop-2-enoyloxyethoxy)benzoate;[1-[2-[3-[4-(2-phenylethynyl)phenyl]prop-2-ynoyloxy]naphthalen-1-yl]naphthalen-2-yl] 3-[4-(2-phenylethynyl)phenyl]prop-2-ynoate;[1-[2-[3-[4-(4-phenylphenyl)phenyl]prop-2-ynoyloxy]naphthalen-1-yl]naphthalen-2-yl] 3-[4-(4-phenylphenyl)phenyl]prop-2-ynoate;[1-[2-[3-(4-phenylphenyl)prop-2-ynoyloxy]naphthalen-1-yl]naphthalen-2-yl] 3-(4-phenylphenyl)prop-2-ynoate
CID 159652969
[1-[3-[6-[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoyl]oxynaphthalene-2-carboxylate
CID 118100011
[1-[3-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-(4-prop-2-enoyloxybutoxy)benzoate
CID 118100009
[4-[(E)-2-[1-[2-[(E)-2-[4-[4-(2-methylprop-2-enoylamino)benzoyl]oxyphenyl]ethenyl]naphthalen-1-yl]naphthalen-2-yl]ethenyl]phenyl] 4-(2-methylprop-2-enoylamino)benzoate
CID 166890086
[1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate
CID 158211855
[4-[4-[(E)-3-ethoxy-3-oxoprop-1-enyl]-2-methoxyphenoxy]carbonylphenyl] 4-(6-prop-2-enoyloxyhexoxy)naphthalene-1-carboxylate
CID 90121438
[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxycyclohexa-1,3-dien-1-yl] 4-(2-methylprop-2-enoylamino)benzoate
CID 137454200
ethane;[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 3-methoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoate
CID 144596343
[4-[[2,5-dichloro-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]iminomethyl]phenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[(E)-C-ethyl-N-[(E)-1-[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]propylideneamino]carbonimidoyl]phenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[3-methyl-4-(4-prop-2-enoxybenzoyl)oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[2-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[2-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(2-methylprop-2-enoylamino)benzoate;[2-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(prop-2-enoylamino)benzoate;[3-methyl-4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]sulfanylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate
CID 172984349
[4-[(E)-3-[1-[2-[(E)-3-(4-benzoyloxyphenyl)prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]phenyl] benzoate
CID 146437675
(4-benzoyloxy-2-methylphenyl) 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[3-methyl-4-[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoyl]oxyphenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(prop-2-enoylamino)benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[3-methyl-4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-(4-octoxyphenyl)phenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-octoxybenzoate;[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;4-[4-[(E)-2-[4-[(E)-2-[4-(4-prop-2-enoyloxybutoxy)phenyl]ethenyl]phenyl]ethenyl]phenoxy]butyl prop-2-enoate
CID 163710411
ethane;[4-[(E)-3-phenylprop-2-enoyl]oxyphenyl] 4-[4-(2-methylprop-2-enoyloxy)butoxy]benzoate;[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-butylbenzoate;[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-ethoxybenzoate;[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-ethylbenzoate;[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-methoxybenzoate;[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-methylbenzoate;[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-propylbenzoate
CID 158080239

Frequently Asked Questions

What is the IUPAC name of [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate?
The IUPAC name of [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate (CID 162154912) is [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate.
What is the SMILES notation for [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate?
The canonical SMILES for [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate is C=C(C)C(=O)Nc1ccc(OC(=O)c2ccc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4ccc(C(=O)Oc5ccc(NC(=O)C(=C)C)cc5)cc4)ccc4ccccc34)cc2)cc1.C=CC(=O)OCCCCOc1ccc(/C=C/C(=O)Cc2ccc3cc(/C=C/C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)/C=C/c5ccc6cc(OC(=O)/C=C/c7ccc(OCCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C/C(=O)Oc3ccc(/C=C/C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)/C=C/c5ccc(OC(=O)/C=C/c6ccc(OC(=O)/C=C/c7ccc(OCCCCOC(=O)C=C)cc7)cc6)cc5)ccc5ccccc45)cc3)cc2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2c(OC)cc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4cc(OC)c(OC(=O)c5ccc(OCCCCOC(=O)C=C)cc5)c(OC)c4)ccc4ccccc34)cc2OC)cc1.C=CC(=O)OCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C/C(=O)Oc3ccc4ccccc4c3-c3c(OC(=O)/C=C/c4ccc(OC(=O)/C=C/c5ccc(OCCOC(=O)C=C)cc5)cc4)ccc4ccccc34)cc2)cc1.
What is the InChIKey of [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate?
The InChIKey is ZLRRHRBIEWTKDF-IQOPMXSHSA-N. The full InChI is InChI=1S/C88H70O18.C79H64O13.C70H62O18.C66H50O14.C60H44N2O10/c1-3-79(89)99-59-11-9-57-97-69-37-17-61(18-38-69)29-51-81(91)101-71-41-21-63(22-42-71)31-53-83(93)103-73-45-25-65(26-46-73)33-55-85(95)105-77-49-35-67-13-5-7-15-75(67)87(77)88-76-16-8-6-14-68(76)36-50-78(88)106-86(96)56-34-66-27-47-74(48-28-66)104-84(94)54-32-64-23-43-72(44-24-64)102-82(92)52-30-62-19-39-70(40-20-62)98-58-10-12-60-100-80(90)4-2;1-3-73(81)88-47-11-9-45-86-66-35-21-54(22-36-66)20-34-65(80)52-58-19-30-61-49-56(17-28-62(61)51-58)26-43-76(84)91-71-40-32-59-13-5-7-15-69(59)78(71)79-70-16-8-6-14-60(70)33-41-72(79)92-77(85)44-27-57-18-29-64-53-68(39-31-63(64)50-57)90-75(83)42-25-55-23-37-67(38-24-55)87-46-10-12-48-89-74(82)4-2;1-7-61(71)83-39-15-13-37-81-51-29-23-49(24-30-51)69(75)87-67-57(77-3)41-45(42-58(67)78-4)21-35-63(73)85-55-33-27-47-17-9-11-19-53(47)65(55)66-54-20-12-10-18-48(54)28-34-56(66)86-64(74)36-22-46-43-59(79-5)68(60(44-46)80-6)88-70(76)50-25-31-52(32-26-50)82-38-14-16-40-84-62(72)8-2;1-3-59(67)75-43-41-73-51-27-13-45(14-28-51)21-37-61(69)77-53-31-17-47(18-32-53)23-39-63(71)79-57-35-25-49-9-5-7-11-55(49)65(57)66-56-12-8-6-10-50(56)26-36-58(66)80-64(72)40-24-48-19-33-54(34-20-48)78-62(70)38-22-46-15-29-52(30-16-46)74-42-44-76-60(68)4-2;1-37(2)57(65)61-45-25-29-47(30-26-45)69-59(67)43-19-13-39(14-20-43)17-35-53(63)71-51-33-23-41-9-5-7-11-49(41)55(51)56-50-12-8-6-10-42(50)24-34-52(56)72-54(64)36-18-40-15-21-44(22-16-40)60(68)70-48-31-27-46(28-32-48)62-58(66)38(3)4/h3-8,13-56H,1-2,9-12,57-60H2;3-8,13-44,49-51,53H,1-2,9-12,45-48,52H2;7-12,17-36,41-44H,1-2,13-16,37-40H2,3-6H3;3-40H,1-2,41-44H2;5-36H,1,3H2,2,4H3,(H,61,65)(H,62,66)/b51-29+,52-30+,53-31+,54-32+,55-33+,56-34+;34-20+,42-25+,43-26+,44-27+;35-21+,36-22+;37-21+,38-22+,39-23+,40-24+;35-17+,36-18+.
What are the key properties of [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate?
[4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate has a molecular weight of 5848.25 g/mol, XLogP of 71.44, 128 rotatable bonds, 2 hydrogen bond donors, and 73 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(E)-3-[1-[2-[(E)-3-[3,5-dimethoxy-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-(2-methylprop-2-enoylamino)phenyl] 4-[(E)-3-[1-[2-[(E)-3-[4-[4-(2-methylprop-2-enoylamino)phenoxy]carbonylphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxy-3-oxoprop-1-enyl]benzoate;[6-[(E)-3-oxo-3-[1-[2-[(E)-3-[6-[(E)-2-oxo-4-[4-(4-prop-2-enoyloxybutoxy)phenyl]but-3-enyl]naphthalen-2-yl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]naphthalen-2-yl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-[(E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenoxy]prop-1-enyl]phenyl] (E)-3-[4-(4-prop-2-enoyloxybutoxy)phenyl]prop-2-enoate;[4-[(E)-3-oxo-3-[1-[2-[(E)-3-[4-[(E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoyl]oxyphenyl]prop-2-enoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxyprop-1-enyl]phenyl] (E)-3-[4-(2-prop-2-enoyloxyethoxy)phenyl]prop-2-enoate is sourced from PubChem (CID 162154912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).