Summary
Molecular formula: C27H40O7
SMILES: OC[C@@]1(C)C(=O)CC[C@]2([C@H]1C[C@H](O)C1=C2C(=O)C[C@]2([C@@]1(C)[C@@H](O)C[C@@H]2[C@@H](CCC(=O)O)C)C)CInChI: InChI=1S/C27H40O7/c1-14(6-7-21(33)34)15-10-20(32)27(5)23-16(29)11-18-24(2,9-8-19(31)25(18,3)13-28)22(23)17(30)12-26(15,27)4/h14-16,18,20,28-29,32H,6-13H2,1-5H3,(H,33,34)/t14-,15-,16+,18-,20+,24+,25-,26-,27+/m1/s1InChIKey: PWSMDKBWXADYJS-HPMFNFBQSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:O=C1CCC2C3=C(CCC2C1)C1CCCC1CC3=O
Scaffold Graph/Node level:OC1CCC2C(CCC3C4CCCC4CC(O)C23)C1
Scaffold Graph level:CC1CCC2C(CCC3C4CCCC4CC(C)C23)C1
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like moleculesClass: Prenol lipids
Sub class: Triterpenoids
Synonymous chemical names:lucidenic acid g
External chemical identifiers:CID_14109386; CAS_102607-21-6; CHEMSPIDER_52085327; ZINC_ZINC000095913336
Chemical structure download