Summary
Molecular formula: C29H40O6
SMILES: C[C@@H](C(=C)CC[C@H](C1CCC2[C@]1(C)CC(=O)C1=C2C(=O)CC2[C@]1(C)CCC(=O)[C@]2(C)O)C)C(=O)OInChI: InChI=1S/C29H40O6/c1-15(17(3)26(33)34)7-8-16(2)18-9-10-19-24-20(30)13-22-27(4,12-11-23(32)29(22,6)35)25(24)21(31)14-28(18,19)5/h16-19,22,35H,1,7-14H2,2-6H3,(H,33,34)/t16-,17+,18?,19?,22?,27+,28-,29-/m1/s1InChIKey: JIKGKDQSOZSLRY-LTGQVMMFSA-N
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
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like moleculesClass: Steroids and steroid derivatives
Sub class: Bile acids, alcohols and derivatives
Synonymous chemical names:(25r)-camphoratins c
Chemical structure download