Summary

Molecular formula: C31H38O8
SMILES: COCC1=C(O)C(=O)[C@H]2[C@]1(C)[C@@H]1C[C@@](C[C@@H]1C2)(C)C(=O)OC1=C2C[C@@H]3[C@H]([C@@]2(C(=C)C1=O)C)C[C@@](C3)(C)C(=O)O
InChI: InChI=1S/C31H38O8/c1-14-22(32)25(18-8-16-9-28(2,26(35)36)11-19(16)30(14,18)4)39-27(37)29(3)10-15-7-17-23(33)24(34)21(13-38-6)31(17,5)20(15)12-29/h15-17,19-20,34H,1,7-13H2,2-6H3,(H,35,36)/t15-,16-,17-,19+,20+,28-,29-,30+,31+/m0/s1
InChIKey: STIOSXDIQODUAH-NVECWKKRSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C=C1C(=O)C(OC(=O)C2CC3CC4C(=O)C=CC4C3C2)=C2CC3CCCC3C12

Scaffold Graph/Node level:
CC1C(O)C(OC(O)C2CC3CC4C(O)CCC4C3C2)C2CC3CCCC3C12

Scaffold Graph level:
CC(CC1C(C)C(C)C2C3CCCC3CC12)C1CC2CC3C(C)CCC3C2C1

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Chemical classification

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

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Synonymous chemical names:
sterhirsutin g

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External chemical identifiers:
CID_122377003; NPATLAS_NPA011478; CHEMSPIDER_78443704

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Chemical structure download