2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate

C274H300O91 — CID 161169650

IUPAC2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate
SMILESCCC(COC(=O)Cc1ccccc1OC(C)=O)(COC(=O)Cc1ccccc1OC(C)=O)COC(=O)Cc1ccccc1OC(C)=O.CCC(COC(=O)c1cc(OC)cc(OC)c1)(COC(=O)c1cc(OC)cc(OC)c1)COC(=O)c1cc(OC)cc(OC)c1.CCC(COC(=O)c1ccc(OC)c(OC)c1)(COC(=O)c1ccc(OC)c(OC)c1)COC(=O)c1ccc(OC)c(OC)c1.CCC(COC(=O)c1ccc(OC)cc1)(COC(=O)c1ccc(OC)cc1)COC(=O)c1ccc(OC)cc1.CCC(COC(=O)c1ccc(OC)cc1OC)(COC(=O)c1ccc(OC)cc1OC)COC(=O)c1ccc(OC)cc1OC.CCC(COC(=O)c1cccc(OC)c1)(COC(=O)c1cccc(OC)c1)COC(=O)c1cccc(OC)c1.COC(=O)c1ccccc1CC(=O)OCC(OC(=O)Cc1ccccc1C(=O)OC)C(COC(=O)Cc1ccccc1C(=O)OC)OC(=O)Cc1ccccc1C(=O)OC.COc1cccc(C(C)C(=O)OCC(C)(COC(=O)C(C)c2cccc(OC)c2)COC(=O)C(C)c2cccc(OC)c2)c1
InChIInChI=1S/C44H42O16.C36H38O12.C35H42O9.3C33H38O12.2C30H32O9/c1-53-41(49)31-17-9-5-13-27(31)21-37(45)57-25-35(59-39(47)23-29-15-7-11-19-33(29)43(51)55-3)36(60-40(48)24-30-16-8-12-20-34(30)44(52)56-4)26-58-38(46)22-28-14-6-10-18-32(28)42(50)54-2;1-5-36(21-43-33(40)18-27-12-6-9-15-30(27)46-24(2)37,22-44-34(41)19-28-13-7-10-16-31(28)47-25(3)38)23-45-35(42)20-29-14-8-11-17-32(29)48-26(4)39;1-23(26-11-8-14-29(17-26)39-5)32(36)42-20-35(4,21-43-33(37)24(2)27-12-9-15-30(18-27)40-6)22-44-34(38)25(3)28-13-10-16-31(19-28)41-7;1-8-33(18-43-30(34)21-9-24(37-2)15-25(10-21)38-3,19-44-31(35)22-11-26(39-4)16-27(12-22)40-5)20-45-32(36)23-13-28(41-6)17-29(14-23)42-7;1-8-33(18-43-30(34)24-12-9-21(37-2)15-27(24)40-5,19-44-31(35)25-13-10-22(38-3)16-28(25)41-6)20-45-32(36)26-14-11-23(39-4)17-29(26)42-7;1-8-33(18-43-30(34)21-9-12-24(37-2)27(15-21)40-5,19-44-31(35)22-10-13-25(38-3)28(16-22)41-6)20-45-32(36)23-11-14-26(39-4)29(17-23)42-7;1-5-30(18-37-27(31)21-6-12-24(34-2)13-7-21,19-38-28(32)22-8-14-25(35-3)15-9-22)20-39-29(33)23-10-16-26(36-4)17-11-23;1-5-30(18-37-27(31)21-9-6-12-24(15-21)34-2,19-38-28(32)22-10-7-13-25(16-22)35-3)20-39-29(33)23-11-8-14-26(17-23)36-4/h5-20,35-36H,21-26H2,1-4H3;6-17H,5,18-23H2,1-4H3;8-19,23-25H,20-22H2,1-7H3;3*9-17H,8,18-20H2,1-7H3;2*6-17H,5,18-20H2,1-4H3
InChIKeyUQZYNAAYTPTRRW-UHFFFAOYSA-N
MW5049.32 g/mol
LogP39.56
Rot. Bonds124

About 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate

2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate (PubChem CID 161169650) has the molecular formula C274H300O91 and a molecular weight of 5049.32 g/mol. Its IUPAC name is 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate.

Molecular Properties

Compound Name2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate
PubChem CID161169650
Molecular FormulaC274H300O91
Molecular Weight5049.32 g/mol
Exact Mass5045.88
IUPAC Name2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate
SMILESCCC(COC(=O)Cc1ccccc1OC(C)=O)(COC(=O)Cc1ccccc1OC(C)=O)COC(=O)Cc1ccccc1OC(C)=O.CCC(COC(=O)c1cc(OC)cc(OC)c1)(COC(=O)c1cc(OC)cc(OC)c1)COC(=O)c1cc(OC)cc(OC)c1.CCC(COC(=O)c1ccc(OC)c(OC)c1)(COC(=O)c1ccc(OC)c(OC)c1)COC(=O)c1ccc(OC)c(OC)c1.CCC(COC(=O)c1ccc(OC)cc1)(COC(=O)c1ccc(OC)cc1)COC(=O)c1ccc(OC)cc1.CCC(COC(=O)c1ccc(OC)cc1OC)(COC(=O)c1ccc(OC)cc1OC)COC(=O)c1ccc(OC)cc1OC.CCC(COC(=O)c1cccc(OC)c1)(COC(=O)c1cccc(OC)c1)COC(=O)c1cccc(OC)c1.COC(=O)c1ccccc1CC(=O)OCC(OC(=O)Cc1ccccc1C(=O)OC)C(COC(=O)Cc1ccccc1C(=O)OC)OC(=O)Cc1ccccc1C(=O)OC.COc1cccc(C(C)C(=O)OCC(C)(COC(=O)C(C)c2cccc(OC)c2)COC(=O)C(C)c2cccc(OC)c2)c1
InChIInChI=1S/C44H42O16.C36H38O12.C35H42O9.3C33H38O12.2C30H32O9/c1-53-41(49)31-17-9-5-13-27(31)21-37(45)57-25-35(59-39(47)23-29-15-7-11-19-33(29)43(51)55-3)36(60-40(48)24-30-16-8-12-20-34(30)44(52)56-4)26-58-38(46)22-28-14-6-10-18-32(28)42(50)54-2;1-5-36(21-43-33(40)18-27-12-6-9-15-30(27)46-24(2)37,22-44-34(41)19-28-13-7-10-16-31(28)47-25(3)38)23-45-35(42)20-29-14-8-11-17-32(29)48-26(4)39;1-23(26-11-8-14-29(17-26)39-5)32(36)42-20-35(4,21-43-33(37)24(2)27-12-9-15-30(18-27)40-6)22-44-34(38)25(3)28-13-10-16-31(19-28)41-7;1-8-33(18-43-30(34)21-9-24(37-2)15-25(10-21)38-3,19-44-31(35)22-11-26(39-4)16-27(12-22)40-5)20-45-32(36)23-13-28(41-6)17-29(14-23)42-7;1-8-33(18-43-30(34)24-12-9-21(37-2)15-27(24)40-5,19-44-31(35)25-13-10-22(38-3)16-28(25)41-6)20-45-32(36)26-14-11-23(39-4)17-29(26)42-7;1-8-33(18-43-30(34)21-9-12-24(37-2)27(15-21)40-5,19-44-31(35)22-10-13-25(38-3)28(16-22)41-6)20-45-32(36)23-11-14-26(39-4)29(17-23)42-7;1-5-30(18-37-27(31)21-6-12-24(34-2)13-7-21,19-38-28(32)22-8-14-25(35-3)15-9-22)20-39-29(33)23-10-16-26(36-4)17-11-23;1-5-30(18-37-27(31)21-9-6-12-24(15-21)34-2,19-38-28(32)22-10-7-13-25(16-22)35-3)20-39-29(33)23-11-8-14-26(17-23)36-4/h5-20,35-36H,21-26H2,1-4H3;6-17H,5,18-23H2,1-4H3;8-19,23-25H,20-22H2,1-7H3;3*9-17H,8,18-20H2,1-7H3;2*6-17H,5,18-20H2,1-4H3
InChIKeyUQZYNAAYTPTRRW-UHFFFAOYSA-N
XLogP39.56
TPSA1090.81 Ų
H-Bond Donors
H-Bond Acceptors91
Rotatable Bonds124
Heavy Atoms365
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005049.32
LogP ≤ 539.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1091

Analyze 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate?
The IUPAC name of 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate (CID 161169650) is 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate.
What is the SMILES notation for 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate?
The canonical SMILES for 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate is CCC(COC(=O)Cc1ccccc1OC(C)=O)(COC(=O)Cc1ccccc1OC(C)=O)COC(=O)Cc1ccccc1OC(C)=O.CCC(COC(=O)c1cc(OC)cc(OC)c1)(COC(=O)c1cc(OC)cc(OC)c1)COC(=O)c1cc(OC)cc(OC)c1.CCC(COC(=O)c1ccc(OC)c(OC)c1)(COC(=O)c1ccc(OC)c(OC)c1)COC(=O)c1ccc(OC)c(OC)c1.CCC(COC(=O)c1ccc(OC)cc1)(COC(=O)c1ccc(OC)cc1)COC(=O)c1ccc(OC)cc1.CCC(COC(=O)c1ccc(OC)cc1OC)(COC(=O)c1ccc(OC)cc1OC)COC(=O)c1ccc(OC)cc1OC.CCC(COC(=O)c1cccc(OC)c1)(COC(=O)c1cccc(OC)c1)COC(=O)c1cccc(OC)c1.COC(=O)c1ccccc1CC(=O)OCC(OC(=O)Cc1ccccc1C(=O)OC)C(COC(=O)Cc1ccccc1C(=O)OC)OC(=O)Cc1ccccc1C(=O)OC.COc1cccc(C(C)C(=O)OCC(C)(COC(=O)C(C)c2cccc(OC)c2)COC(=O)C(C)c2cccc(OC)c2)c1.
What is the InChIKey of 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate?
The InChIKey is UQZYNAAYTPTRRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H42O16.C36H38O12.C35H42O9.3C33H38O12.2C30H32O9/c1-53-41(49)31-17-9-5-13-27(31)21-37(45)57-25-35(59-39(47)23-29-15-7-11-19-33(29)43(51)55-3)36(60-40(48)24-30-16-8-12-20-34(30)44(52)56-4)26-58-38(46)22-28-14-6-10-18-32(28)42(50)54-2;1-5-36(21-43-33(40)18-27-12-6-9-15-30(27)46-24(2)37,22-44-34(41)19-28-13-7-10-16-31(28)47-25(3)38)23-45-35(42)20-29-14-8-11-17-32(29)48-26(4)39;1-23(26-11-8-14-29(17-26)39-5)32(36)42-20-35(4,21-43-33(37)24(2)27-12-9-15-30(18-27)40-6)22-44-34(38)25(3)28-13-10-16-31(19-28)41-7;1-8-33(18-43-30(34)21-9-24(37-2)15-25(10-21)38-3,19-44-31(35)22-11-26(39-4)16-27(12-22)40-5)20-45-32(36)23-13-28(41-6)17-29(14-23)42-7;1-8-33(18-43-30(34)24-12-9-21(37-2)15-27(24)40-5,19-44-31(35)25-13-10-22(38-3)16-28(25)41-6)20-45-32(36)26-14-11-23(39-4)17-29(26)42-7;1-8-33(18-43-30(34)21-9-12-24(37-2)27(15-21)40-5,19-44-31(35)22-10-13-25(38-3)28(16-22)41-6)20-45-32(36)23-11-14-26(39-4)29(17-23)42-7;1-5-30(18-37-27(31)21-6-12-24(34-2)13-7-21,19-38-28(32)22-8-14-25(35-3)15-9-22)20-39-29(33)23-10-16-26(36-4)17-11-23;1-5-30(18-37-27(31)21-9-6-12-24(15-21)34-2,19-38-28(32)22-10-7-13-25(16-22)35-3)20-39-29(33)23-11-8-14-26(17-23)36-4/h5-20,35-36H,21-26H2,1-4H3;6-17H,5,18-23H2,1-4H3;8-19,23-25H,20-22H2,1-7H3;3*9-17H,8,18-20H2,1-7H3;2*6-17H,5,18-20H2,1-4H3.
What are the key properties of 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate?
2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate has a molecular weight of 5049.32 g/mol, XLogP of 39.56, 124 rotatable bonds, 0 hydrogen bond donors, and 91 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis[[2-(2-acetyloxyphenyl)acetyl]oxymethyl]butyl 2-(2-acetyloxyphenyl)acetate;2,2-bis[(2,4-dimethoxybenzoyl)oxymethyl]butyl 2,4-dimethoxybenzoate;2,2-bis[(3,4-dimethoxybenzoyl)oxymethyl]butyl 3,4-dimethoxybenzoate;2,2-bis[(3,5-dimethoxybenzoyl)oxymethyl]butyl 3,5-dimethoxybenzoate;2,2-bis[(3-methoxybenzoyl)oxymethyl]butyl 3-methoxybenzoate;2,2-bis[(4-methoxybenzoyl)oxymethyl]butyl 4-methoxybenzoate;[3-[2-(3-methoxyphenyl)propanoyloxy]-2-[2-(3-methoxyphenyl)propanoyloxymethyl]-2-methylpropyl] 2-(3-methoxyphenyl)propanoate;methyl 2-[2-oxo-2-[2,3,4-tris[[2-(2-methoxycarbonylphenyl)acetyl]oxy]butoxy]ethyl]benzoate is sourced from PubChem (CID 161169650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).