Summary

Molecular formula: C32H48O5
SMILES: CC(=CCC(=O)[C@H]([C@H]1CC[C@@]2([C@]1(C)CCC1=C2CC[C@@H]2[C@]1(C)CC[C@H](C2(C)C)OC(=O)C)C)C(=O)O)C
InChI: InChI=1S/C32H48O5/c1-19(2)9-11-24(34)27(28(35)36)23-14-18-31(7)22-10-12-25-29(4,5)26(37-20(3)33)15-16-30(25,6)21(22)13-17-32(23,31)8/h9,23,25-27H,10-18H2,1-8H3,(H,35,36)/t23-,25+,26-,27+,30-,31+,32-/m1/s1
InChIKey: YOZMIRKSGPYKDL-KKMRMNOUSA-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:
tsugaric acid d

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External chemical identifiers:
CHEMSPIDER_58825951

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Chemical structure download