Summary
Molecular formula: C28H46O
SMILES: O[C@H]1CC[C@]2([C@H](C1)CC=C1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@@H](/C=C/[C@H](C(C)C)C)C)C)CInChI: InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,10,18-22,24-26,29H,9,11-17H2,1-6H3/b8-7+/t19-,20-,21+,22+,24-,25+,26+,27+,28-/m1/s1InChIKey: QOXPZVASXWSKKU-YHXQVCFYSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:C1=C2C3CCCC3CCC2C2CCCCC2C1
Scaffold Graph/Node level:C1CCC2C(C1)CCC1C3CCCC3CCC21
Scaffold Graph level:C1CCC2C(C1)CCC1C3CCCC3CCC21
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like moleculesClass: Steroids and steroid derivatives
Sub class: Ergostane steroids
Synonymous chemical names:ergosta-7,22-dien-3-ol, (3.beta.,5.alpha.,22e)-
External chemical identifiers:CID_5283669; CHEMSPIDER_4446722; ZINC_ZINC000033820624
Chemical structure download