Summary

Molecular formula: C31H42O7
SMILES: COC(=O)CC[C@@]1(C)[C@@H](C[C@@H]2[C@]3(C1=CC(=O)[C@]1([C@@]3(C)[C@@H](O)C[C@@H]1C(=C[C@@H]1OC(=O)[C@H](C1)C)C)C)O2)C(=C)C
InChI: InChI=1S/C31H42O7/c1-16(2)20-14-25-31(38-25)22(28(20,5)10-9-26(34)36-8)15-23(32)29(6)21(13-24(33)30(29,31)7)17(3)11-19-12-18(4)27(35)37-19/h11,15,18-21,24-25,33H,1,9-10,12-14H2,2-8H3/t18-,19-,20-,21+,24-,25+,28-,29-,30+,31-/m0/s1
InChIKey: XMYLZWSISVUIGW-PYGZSJEDSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CCC(C=CC2CCC3C2C(=O)C=C2CCCC4OC243)O1

Scaffold Graph/Node level:
OC1CCC(CCC2CCC3C2C(O)CC2CCCC4OC243)O1

Scaffold Graph level:
CC1CCC(CCC2CCC3C2C(C)CC2CCCC4CC243)C1

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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:
gibbosicolid g

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External chemical identifiers:
CID_145721199; NPATLAS_NPA025436

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Chemical structure download