Summary

Molecular formula: C30H41NO6
SMILES: C[C@H]1C[C@H](C)/C=C/[C@H]([C@@]23C(=C[C@](C)(O)[C@H]([C@H]3[C@@H](NC2=O)Cc2ccccc2)C)[C@@H]([C@H](C1)O)O)OC(=O)C
InChI: InChI=1S/C30H41NO6/c1-17-11-12-25(37-20(4)32)30-22(27(34)24(33)14-18(2)13-17)16-29(5,36)19(3)26(30)23(31-28(30)35)15-21-9-7-6-8-10-21/h6-12,16-19,23-27,33-34,36H,13-15H2,1-5H3,(H,31,35)/b12-11+/t17-,18+,19+,23+,24+,25-,26+,27+,29+,30-/m1/s1
InChIKey: VAIGPVOBMHLZKR-NIHSEUEPSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1NC(Cc2ccccc2)C2CCC=C3CCCCCCC=CCC132

Scaffold Graph/Node level:
OC1NC(CC2CCCCC2)C2CCCC3CCCCCCCCCC312

Scaffold Graph level:
CC1CC(CC2CCCCC2)C2CCCC3CCCCCCCCCC132

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Isoindoles and derivatives
Sub class: Isoindolines

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Synonymous chemical names:
21-(acetyloxy)-6,13,14-trihydroxy-16,18-dimethyl-10-phenyl[11]cytochalasa-7,19-dien-1-one

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Chemical structure download