Summary
Molecular formula: C30H50O2
SMILES: CC(C(=C)C[C@H]([C@H]([C@H]1CC[C@@]2([C@]1(C)CCC1=C2CCC2[C@]1(C)CC[C@H]([C@H]2C)O)C)C)O)CInChI: InChI=1S/C30H50O2/c1-18(2)19(3)17-27(32)21(5)23-11-15-30(8)25-10-9-22-20(4)26(31)13-14-28(22,6)24(25)12-16-29(23,30)7/h18,20-23,26-27,31-32H,3,9-17H2,1-2,4-8H3/t20-,21-,22?,23+,26+,27+,28-,29+,30-/m0/s1InChIKey: SJGDDDWMCGNKNE-DNAHYVPOSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:C1CCC2C3=C(CCC2C1)C1CCCC1CC3
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: Bile acids, alcohols and derivatives
Synonymous chemical names:igniaren c
External chemical identifiers:CID_139583386; NPATLAS_NPA001045; CHEMSPIDER_78440732
Chemical structure download