Summary

Molecular formula: C30H46O7
SMILES: COC(=O)[C@@H](C(=C)CC[C@H](C1CC[C@@]2([C@]1(C)CC(=O)C1=C2[C@@H](O)CC2[C@]1(C)CC[C@H]([C@]2(C)O)O)O)C)C
InChI: InChI=1S/C30H46O7/c1-16(18(3)26(34)37-7)8-9-17(2)19-10-13-30(36)25-20(31)14-22-27(4,12-11-23(33)29(22,6)35)24(25)21(32)15-28(19,30)5/h17-20,22-23,31,33,35-36H,1,8-15H2,2-7H3/t17-,18-,19?,20+,22?,23-,27+,28-,29-,30-/m1/s1
InChIKey: WSZVGMNOEJUWLN-IAYARMJDSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CC2CCCC2C2=C1C1CCCCC1CC2

Scaffold Graph/Node level:
OC1CC2CCCC2C2CCC3CCCCC3C12

Scaffold Graph level:
CC1CC2CCCC2C2CCC3CCCCC3C12

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Steroids and steroid derivatives
Sub class: Bile acids, alcohols and derivatives

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Synonymous chemical names:
(25r)-methyl antcinate k

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Chemical structure download