Summary

Molecular formula: C36H56O8
SMILES: CCOC(=O)CC(=O)O[C@@H]1CC[C@]2(C(C1(C)C)CCC1=C2C[C@@H](O)[C@]2([C@@]1(C)CCC2C(CC(=O)[C@H]([C@@H](C(=O)O)C)C)C)C)C
InChI: InChI=1S/C36H56O8/c1-10-43-30(39)19-31(40)44-29-14-15-34(7)25-18-28(38)36(9)23(20(2)17-26(37)21(3)22(4)32(41)42)13-16-35(36,8)24(25)11-12-27(34)33(29,5)6/h20-23,27-29,38H,10-19H2,1-9H3,(H,41,42)/t20?,21-,22-,23?,27?,28+,29+,34+,35-,36-/m0/s1
InChIKey: VEOFXBSUJGYRHH-RSANHPTMSA-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:
fomitopsin d ethyl ester

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Chemical structure download