Summary
Molecular formula: C29H42O6
SMILES: C[C@@H](C(=C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C(=O)C1=C2C(=O)C[C@@H]2[C@]1(C)CC[C@H]([C@H]2C)O)C)C(=O)OInChI: InChI=1S/C29H42O6/c1-14(16(3)27(34)35)7-8-15(2)18-9-10-19-23-22(31)13-20-17(4)21(30)11-12-28(20,5)24(23)25(32)26(33)29(18,19)6/h15-21,26,30,33H,1,7-13H2,2-6H3,(H,34,35)/t15-,16+,17+,18-,19+,20+,21-,26+,28+,29-/m1/s1InChIKey: LVFHKUZOQUATIE-KEBSMKNNSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:O=C1CC2CCCCC2C2=C1C1CCCC1CC2=O
Scaffold Graph/Node level:OC1CC2CCCC2C2C(O)CC3CCCCC3C12
Scaffold Graph level:CC1CC2CCCC2C2C(C)CC3CCCCC3C12
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:antcin h, antcin-h, zhankuic acid c
External chemical identifiers:CID_53318662, CID_68150384; ZINC_ZINC000042851383
Chemical structure download