Summary

Molecular formula: C31H44O8
SMILES: COC(=O)C(CC(=O)C[C@@]([C@H]1CC(=O)[C@@]2([C@]1(C)CC(=O)C1=C2C(=O)CC2[C@]1(C)CC[C@@H](C2(C)C)O)C)(O)C)C
InChI: InChI=1S/C31H44O8/c1-16(26(37)39-8)11-17(32)14-30(6,38)21-13-23(36)31(7)25-18(33)12-20-27(2,3)22(35)9-10-28(20,4)24(25)19(34)15-29(21,31)5/h16,20-22,35,38H,9-15H2,1-8H3/t16?,20?,21-,22-,28-,29+,30-,31-/m0/s1
InChIKey: GWXYUYTZJNWGAD-GOUAKDDGSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CC2CCC(=O)C2C2=C1C1CCCCC1CC2=O

Scaffold Graph/Node level:
OC1CCC2CC(O)C3C4CCCCC4CC(O)C3C12

Scaffold Graph level:
CC1CCC2CC(C)C3C4CCCCC4CC(C)C3C12

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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:
resinacein p

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External chemical identifiers:
CID_139590944; NPATLAS_NPA023690; CHEMSPIDER_78442402

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Chemical structure download