Summary
Molecular formula: C27H36O6
SMILES: OC(=O)CCC(=C)[C@H]1CC(=O)[C@@]2([C@]1(C)CC(=O)C1=C2[C@@H](O)C[C@@H]2[C@]1(C)CCC(=O)C2(C)C)CInChI: InChI=1S/C27H36O6/c1-14(7-8-21(32)33)15-11-20(31)27(6)23-16(28)12-18-24(2,3)19(30)9-10-25(18,4)22(23)17(29)13-26(15,27)5/h15-16,18,28H,1,7-13H2,2-6H3,(H,32,33)/t15-,16+,18+,25+,26-,27+/m1/s1InChIKey: APMICFQMLNFXRZ-LIFSRMHQSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:O=C1CCC2C3=C(CCC2C1)C1C(=O)CCC1CC3=O
Scaffold Graph/Node level:OC1CCC2C(CCC3C4C(O)CCC4CC(O)C23)C1
Scaffold Graph level:CC1CCC2C(CCC3C4C(C)CCC4CC(C)C23)C1
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like moleculesClass: Steroids and steroid derivatives
Sub class: Oxosteroids
Synonymous chemical names:20(21)-dehydrolucidenic acid a
External chemical identifiers:CID_11340050; NPATLAS_NPA015361; CHEMSPIDER_9514993; ZINC_ZINC000255196226
Chemical structure download