Summary

Molecular formula: C30H44O5
SMILES: OCC(=CCC[C@H]([C@H]1CC[C@@]2([C@]1(C)CC(=O)C1=C2C(=O)C[C@@H]2[C@]1(C)CCC(=O)C2(C)C)C)C)CO
InChI: InChI=1S/C30H44O5/c1-18(8-7-9-19(16-31)17-32)20-10-13-29(5)26-21(33)14-23-27(2,3)24(35)11-12-28(23,4)25(26)22(34)15-30(20,29)6/h9,18,20,23,31-32H,7-8,10-17H2,1-6H3/t18-,20-,23+,28+,29+,30-/m1/s1
InChIKey: WCLWCQITMZPHAW-HPVDZYFSSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CCC2C3=C(C(=O)CC2C1)C1CCCC1CC3=O

Scaffold Graph/Node level:
OC1CCC2C(C1)CC(O)C1C3CCCC3CC(O)C21

Scaffold Graph level:
CC1CCC2C(C1)CC(C)C1C3CCCC3CC(C)C21

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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:
ganoleuconin h

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External chemical identifiers:
CID_122182458; NPATLAS_NPA013238; CHEMSPIDER_59002629; ZINC_ZINC000473094780

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Chemical structure download