Summary

Molecular formula: C30H50O2
SMILES: CC(=CCC[C@H]([C@H]1CC[C@@]2([C@]1(C)C[C@H](O)C1=C2CC[C@@H]2[C@]1(C)CC[C@@H](C2(C)C)O)C)C)C
InChI: InChI=1S/C30H50O2/c1-19(2)10-9-11-20(3)21-14-17-29(7)22-12-13-24-27(4,5)25(32)15-16-28(24,6)26(22)23(31)18-30(21,29)8/h10,20-21,23-25,31-32H,9,11-18H2,1-8H3/t20-,21-,23+,24+,25+,28+,29+,30-/m1/s1
InChIKey: WNVDPHMLWOSJRD-NFIKTEJASA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCC2C3=C(CCC2C1)C1CCCC1CC3

Scaffold Graph/Node level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

Scaffold Graph level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Triterpenoids

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Synonymous chemical names:
inonotsudiol a

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External chemical identifiers:
CID_49780665; NPATLAS_NPA018369; CHEMSPIDER_78444386

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Chemical structure download