(2,4-dimethoxyphenyl)methyl (E,5R)-5-[(1R,4Z,7Z,9R,13R,14R)-9-acetyloxy-4-chloranyl-11-oxidanylidene-8-(propanoyloxymethyl)-12,15-dioxabicyclo[11.2.1]hexadeca-4,7-dien-14-yl]-3-methyl-5-oxidanyl-pent-3-enoate

Systemtic Name: (2,4-dimethoxyphenyl)methyl (E,5R)-5-[(1R,4Z,7Z,9R,13R,14R)-9-acetyloxy-4-chloranyl-11-oxidanylidene-8-(propanoyloxymethyl)-12,15-dioxabicyclo[11.2.1]hexadeca-4,7-dien-14-yl]-3-methyl-5-oxidanyl-pent-3-enoate Openeye Name: (2,4-dimethoxyphenyl)methyl (E,5R)-5-[(1R,4Z,7Z,9R,13R,14R)-9-acetoxy-4-chloro-11-oxo-8-(propanoyloxymethyl)-12,15-dioxabicyclo[11.2.1]hexadeca-4,7-dien-14-yl]-5-hydroxy-3-methyl-pent-3-enoate CAS Name: (E,5R)-5-[(1R,4Z,7Z,9R,13R,14R)-9-acetyloxy-4-chloro-11-oxo-8-(1-oxopropoxymethyl)-12,15-dioxabicyclo[11.2.1]hexadeca-4,7-dien-14-yl]-5-hydroxy-3-methyl-3-pentenoic acid (2,4-dimethoxyphenyl)methyl ester IUPAC Name: (2,4-dimethoxyphenyl)methyl (E,5R)-5-[(1R,4Z,7Z,9R,13R,14R)-9-acetyloxy-4-chloro-11-oxo-8-(propanoyloxymethyl)-12,15-dioxabicyclo[11.2.1]hexadeca-4,7-dien-14-yl]-5-hydroxy-3-methylpent-3-enoate Traditional Name: (E,5R)-5-[(1R,4Z,7Z,9R,13R,14R)-9-acetoxy-4-chloro-11-keto-8-(propionyloxymethyl)-12,15-dioxabicyclo[11.2.1]hexadeca-4,7-dien-14-yl]-5-hydroxy-3-methyl-pent-3-enoic acid (2,4-dimethoxybenzyl) ester Formula: C35H45ClO12 MolecularWeight: 693.1776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC1=CCC=C(CCC2CC(C(O2)C(C=C(C)CC(=O)OCC3=C(C=C(C=C3)OC)OC)O)OC(=O)CC1OC(=O)C)Cl

Isomeric SMILES

CCC(=O)OC/C/1=C/C/C=C(/CC[C@@H]2C[C@H]([C@H](O2)[C@@H](/C=C(\C)/CC(=O)OCC3=C(C=C(C=C3)OC)OC)O)OC(=O)C[C@H]1OC(=O)C)\Cl

InChI

InChI=1S/C35H45ClO12/c1-6-32(39)44-19-23-8-7-9-25(36)11-13-27-17-31(48-34(41)18-30(23)46-22(3)37)35(47-27)28(38)14-21(2)15-33(40)45-20-24-10-12-26(42-4)16-29(24)43-5/h8-10,12,14,16,27-28,30-31,35,38H,6-7,11,13,15,17-20H2,1-5H3/b21-14+,23-8-,25-9-/t27-,28-,30-,31-,35-/m1/s1