Summary
Molecular formula: C30H48O2
SMILES: OC[C@@H]([C@H]1CC[C@@]2([C@]1(C)CCC1=C2CC[C@@H]2[C@]1(C)CCC(=O)C2(C)C)C)CCC=C(C)CInChI: InChI=1S/C30H48O2/c1-20(2)9-8-10-21(19-31)22-13-17-30(7)24-11-12-25-27(3,4)26(32)15-16-28(25,5)23(24)14-18-29(22,30)6/h9,21-22,25,31H,8,10-19H2,1-7H3/t21-,22+,25-,28+,29+,30-/m0/s1InChIKey: OEQYASIYRZNOIT-KTKIDDBTSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:O=C1CCC2C3=C(CCC2C1)C1CCCC1CC3
Scaffold Graph/Node level:OC1CCC2C(CCC3C4CCCC4CCC23)C1
Scaffold Graph level:CC1CCC2C(CCC3C4CCCC4CCC23)C1
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like moleculesClass: Prenol lipids
Sub class: Triterpenoids
Synonymous chemical names:21-hydroxylanosta-8,24-dien-3-one
External chemical identifiers:CID_15292988; NPATLAS_NPA012903; ZINC_ZINC000034526584
Chemical structure download