25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene

C326H187NO6 — CID 157320827

IUPAC25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene
SMILESc1ccc(-c2c3ccccc3c(-c3c4ccccc4c(-c4ccc5oc6cc7c8ccccc8c8cc9ccccc9cc8c7cc6c5c4)c4ccccc34)c3ccccc23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4c5ccccc5c(-c5c6ccccc6c(-c6ccc7oc8cc9c%10ccccc%10c%10cc%11ccccc%11cc%10c9cc8c7c6)c6ccccc56)c5ccccc45)ccc32)cc1.c1ccc2cc(-c3c4ccccc4c(-c4c5ccccc5c(-c5ccc6oc7cc8c9ccccc9c9cc%10ccccc%10cc9c8cc7c6c5)c5ccccc45)c4ccccc34)ccc2c1.c1ccc2cc3c(cc2c1)c1ccccc1c1cc2oc4ccc(-c5c6ccccc6c(-c6c7ccccc7c(-c7ccc8oc9ccccc9c8c7)c7ccccc67)c6ccccc56)cc4c2cc31.c1ccc2cc3c(cc2c1)c1ccccc1c1cc2oc4ccc(-c5c6ccccc6c(-c6c7ccccc7cc7ccccc67)c6ccccc56)cc4c2cc31
InChIInChI=1S/C74H43NO.C68H38O2.C66H38O.C62H36O.C56H32O/c1-2-20-48(21-3-1)75-67-33-17-16-24-51(67)64-40-46(34-36-68(64)75)71-52-25-8-12-29-56(52)73(57-30-13-9-26-53(57)71)74-58-31-14-10-27-54(58)72(55-28-11-15-32-59(55)74)47-35-37-69-65(41-47)66-42-62-61-39-45-19-5-4-18-44(45)38-60(61)49-22-6-7-23-50(49)63(62)43-70(66)76-69;1-2-16-40-34-55-54(33-39(40)15-1)43-17-3-4-18-44(43)57-38-64-60(37-56(55)57)59-36-42(30-32-63(59)70-64)66-48-22-7-11-26-52(48)68(53-27-12-8-23-49(53)66)67-50-24-9-5-20-46(50)65(47-21-6-10-25-51(47)67)41-29-31-62-58(35-41)45-19-13-14-28-61(45)69-62;1-2-16-40-33-43(30-29-39(40)15-1)63-47-21-7-11-25-51(47)65(52-26-12-8-22-48(52)63)66-53-27-13-9-23-49(53)64(50-24-10-14-28-54(50)66)44-31-32-61-59(36-44)60-37-57-56-35-42-18-4-3-17-41(42)34-55(56)45-19-5-6-20-46(45)58(57)38-62(60)67-61;1-2-16-37(17-3-1)59-43-22-8-12-26-47(43)61(48-27-13-9-23-44(48)59)62-49-28-14-10-24-45(49)60(46-25-11-15-29-50(46)62)40-30-31-57-55(34-40)56-35-53-52-33-39-19-5-4-18-38(39)32-51(52)41-20-6-7-21-42(41)54(53)36-58(56)63-57;1-2-14-34-29-47-46(28-33(34)13-1)40-19-7-8-20-41(40)49-32-53-51(31-48(47)49)50-30-37(25-26-52(50)57-53)54-42-21-9-11-23-44(42)56(45-24-12-10-22-43(45)54)55-38-17-5-3-15-35(38)27-36-16-4-6-18-39(36)55/h1-43H;1-38H;1-38H;1-36H;1-32H
InChIKeyBEDIZUJQNJMREO-UHFFFAOYSA-N
MW4214.08 g/mol
LogP93.55
Rot. Bonds15

About 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene

25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene (PubChem CID 157320827) has the molecular formula C326H187NO6 and a molecular weight of 4214.08 g/mol. Its IUPAC name is 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene.

Molecular Properties

Compound Name25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene
PubChem CID157320827
Molecular FormulaC326H187NO6
Molecular Weight4214.08 g/mol
Exact Mass4210.44
IUPAC Name25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene
SMILESc1ccc(-c2c3ccccc3c(-c3c4ccccc4c(-c4ccc5oc6cc7c8ccccc8c8cc9ccccc9cc8c7cc6c5c4)c4ccccc34)c3ccccc23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4c5ccccc5c(-c5c6ccccc6c(-c6ccc7oc8cc9c%10ccccc%10c%10cc%11ccccc%11cc%10c9cc8c7c6)c6ccccc56)c5ccccc45)ccc32)cc1.c1ccc2cc(-c3c4ccccc4c(-c4c5ccccc5c(-c5ccc6oc7cc8c9ccccc9c9cc%10ccccc%10cc9c8cc7c6c5)c5ccccc45)c4ccccc34)ccc2c1.c1ccc2cc3c(cc2c1)c1ccccc1c1cc2oc4ccc(-c5c6ccccc6c(-c6c7ccccc7c(-c7ccc8oc9ccccc9c8c7)c7ccccc67)c6ccccc56)cc4c2cc31.c1ccc2cc3c(cc2c1)c1ccccc1c1cc2oc4ccc(-c5c6ccccc6c(-c6c7ccccc7cc7ccccc67)c6ccccc56)cc4c2cc31
InChIInChI=1S/C74H43NO.C68H38O2.C66H38O.C62H36O.C56H32O/c1-2-20-48(21-3-1)75-67-33-17-16-24-51(67)64-40-46(34-36-68(64)75)71-52-25-8-12-29-56(52)73(57-30-13-9-26-53(57)71)74-58-31-14-10-27-54(58)72(55-28-11-15-32-59(55)74)47-35-37-69-65(41-47)66-42-62-61-39-45-19-5-4-18-44(45)38-60(61)49-22-6-7-23-50(49)63(62)43-70(66)76-69;1-2-16-40-34-55-54(33-39(40)15-1)43-17-3-4-18-44(43)57-38-64-60(37-56(55)57)59-36-42(30-32-63(59)70-64)66-48-22-7-11-26-52(48)68(53-27-12-8-23-49(53)66)67-50-24-9-5-20-46(50)65(47-21-6-10-25-51(47)67)41-29-31-62-58(35-41)45-19-13-14-28-61(45)69-62;1-2-16-40-33-43(30-29-39(40)15-1)63-47-21-7-11-25-51(47)65(52-26-12-8-22-48(52)63)66-53-27-13-9-23-49(53)64(50-24-10-14-28-54(50)66)44-31-32-61-59(36-44)60-37-57-56-35-42-18-4-3-17-41(42)34-55(56)45-19-5-6-20-46(45)58(57)38-62(60)67-61;1-2-16-37(17-3-1)59-43-22-8-12-26-47(43)61(48-27-13-9-23-44(48)59)62-49-28-14-10-24-45(49)60(46-25-11-15-29-50(46)62)40-30-31-57-55(34-40)56-35-53-52-33-39-19-5-4-18-38(39)32-51(52)41-20-6-7-21-42(41)54(53)36-58(56)63-57;1-2-14-34-29-47-46(28-33(34)13-1)40-19-7-8-20-41(40)49-32-53-51(31-48(47)49)50-30-37(25-26-52(50)57-53)54-42-21-9-11-23-44(42)56(45-24-12-10-22-43(45)54)55-38-17-5-3-15-35(38)27-36-16-4-6-18-39(36)55/h1-43H;1-38H;1-38H;1-36H;1-32H
InChIKeyBEDIZUJQNJMREO-UHFFFAOYSA-N
XLogP93.55
TPSA83.77 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds15
Heavy Atoms333
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004214.08
LogP ≤ 593.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-naphthalen-2-yl-6-naphtho[2,3-b][1]benzofuran-2-yl-1,3,5-triazin-2-yl)-9-phenylcarbazole
CID 163772071
1-dibenzofuran-2-yl-2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;9-phenyl-2-[2-[4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran-1-yl]carbazole
CID 167624935
8-(10-dibenzofuran-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;3-(10-naphtho[2,1-b][1]benzofuran-10-ylanthracen-9-yl)-9-phenylcarbazole;10-(10-phenanthren-9-ylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;8-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;10-(10-phenylanthracen-9-yl)naphtho[2,1-b][1]benzofuran;2-[4-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;8-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;10-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran
CID 158188229
9-phenyl-3-[10-(2-phenyl-[1]benzofuro[5,6-b][1]benzofuran-1-yl)anthracen-9-yl]carbazole
CID 176743067
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;bis(9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole)
CID 161012876
7-naphthalen-2-yl-2-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)indolo[2,3-b]carbazole;2-(9-phenylcarbazol-3-yl)-5,7-bis(4-phenylphenyl)indolo[2,3-b]carbazole;10-(9-phenylcarbazol-3-yl)-7-(4-phenylphenyl)-[1]benzofuro[2,3-b]carbazole
CID 158696933
2-[10-(21-oxaheptacyclo[16.11.0.02,11.03,8.012,17.020,28.022,27]nonacosa-1(18),2(11),3,5,7,9,12,14,16,19,22(27),23,25,28-tetradecaen-24-yl)anthracen-9-yl]-5,11-diphenylindolo[3,2-b]carbazole
CID 155008129
2-(10-dibenzofuran-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-[10-(4-dibenzofuran-4-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;3-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-9-phenylcarbazole;9-[3-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]carbazole;9-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]carbazole
CID 159221767
3-[9-(3-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole
CID 118534493
7,17-di(phenanthren-9-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaene;3-[17-(6,9-diphenylcarbazol-3-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-7-yl]-6,9-diphenylcarbazole;7,17-di(triphenylen-2-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaene;9-phenyl-3-[17-(9-phenylcarbazol-3-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole
CID 159138174
3-(8,15-dioxatetracyclo[14.4.0.02,7.09,14]icosa-1(20),2(7),3,5,9,11,13,16,18-nonaen-4-yl)-9-phenylcarbazole
CID 145223329
N-(4-naphthalen-2-ylphenyl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-2-amine
CID 58510646

Frequently Asked Questions

What is the IUPAC name of 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene?
The IUPAC name of 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene (CID 157320827) is 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene.
What is the SMILES notation for 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene?
The canonical SMILES for 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene is c1ccc(-c2c3ccccc3c(-c3c4ccccc4c(-c4ccc5oc6cc7c8ccccc8c8cc9ccccc9cc8c7cc6c5c4)c4ccccc34)c3ccccc23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4c5ccccc5c(-c5c6ccccc6c(-c6ccc7oc8cc9c%10ccccc%10c%10cc%11ccccc%11cc%10c9cc8c7c6)c6ccccc56)c5ccccc45)ccc32)cc1.c1ccc2cc(-c3c4ccccc4c(-c4c5ccccc5c(-c5ccc6oc7cc8c9ccccc9c9cc%10ccccc%10cc9c8cc7c6c5)c5ccccc45)c4ccccc34)ccc2c1.c1ccc2cc3c(cc2c1)c1ccccc1c1cc2oc4ccc(-c5c6ccccc6c(-c6c7ccccc7c(-c7ccc8oc9ccccc9c8c7)c7ccccc67)c6ccccc56)cc4c2cc31.c1ccc2cc3c(cc2c1)c1ccccc1c1cc2oc4ccc(-c5c6ccccc6c(-c6c7ccccc7cc7ccccc67)c6ccccc56)cc4c2cc31.
What is the InChIKey of 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene?
The InChIKey is BEDIZUJQNJMREO-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H43NO.C68H38O2.C66H38O.C62H36O.C56H32O/c1-2-20-48(21-3-1)75-67-33-17-16-24-51(67)64-40-46(34-36-68(64)75)71-52-25-8-12-29-56(52)73(57-30-13-9-26-53(57)71)74-58-31-14-10-27-54(58)72(55-28-11-15-32-59(55)74)47-35-37-69-65(41-47)66-42-62-61-39-45-19-5-4-18-44(45)38-60(61)49-22-6-7-23-50(49)63(62)43-70(66)76-69;1-2-16-40-34-55-54(33-39(40)15-1)43-17-3-4-18-44(43)57-38-64-60(37-56(55)57)59-36-42(30-32-63(59)70-64)66-48-22-7-11-26-52(48)68(53-27-12-8-23-49(53)66)67-50-24-9-5-20-46(50)65(47-21-6-10-25-51(47)67)41-29-31-62-58(35-41)45-19-13-14-28-61(45)69-62;1-2-16-40-33-43(30-29-39(40)15-1)63-47-21-7-11-25-51(47)65(52-26-12-8-22-48(52)63)66-53-27-13-9-23-49(53)64(50-24-10-14-28-54(50)66)44-31-32-61-59(36-44)60-37-57-56-35-42-18-4-3-17-41(42)34-55(56)45-19-5-6-20-46(45)58(57)38-62(60)67-61;1-2-16-37(17-3-1)59-43-22-8-12-26-47(43)61(48-27-13-9-23-44(48)59)62-49-28-14-10-24-45(49)60(46-25-11-15-29-50(46)62)40-30-31-57-55(34-40)56-35-53-52-33-39-19-5-4-18-38(39)32-51(52)41-20-6-7-21-42(41)54(53)36-58(56)63-57;1-2-14-34-29-47-46(28-33(34)13-1)40-19-7-8-20-41(40)49-32-53-51(31-48(47)49)50-30-37(25-26-52(50)57-53)54-42-21-9-11-23-44(42)56(45-24-12-10-22-43(45)54)55-38-17-5-3-15-35(38)27-36-16-4-6-18-39(36)55/h1-43H;1-38H;1-38H;1-36H;1-32H.
What are the key properties of 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene?
25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene has a molecular weight of 4214.08 g/mol, XLogP of 93.55, 15 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 25-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-dibenzofuran-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;25-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene;3-[10-[10-(21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]-9-phenylcarbazole;25-[10-(10-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaene is sourced from PubChem (CID 157320827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).