Summary
Molecular formula: C25H32O3
SMILES: COc1ccc2c(c1C)C=C[C@]13[C@]2(C)CCC3=C(C(=O)[C@H]1[C@@H](C(O)(C)C)C)CInChI: InChI=1S/C25H32O3/c1-14-17-10-13-25-18(15(2)22(26)21(25)16(3)23(4,5)27)11-12-24(25,6)19(17)8-9-20(14)28-7/h8-10,13,16,21,27H,11-12H2,1-7H3/t16-,21+,24+,25+/m0/s1InChIKey: KEJYTPFHXXTRCU-HXGHLDGBSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:O=C1C=C2CCC3c4ccccc4C=CC23C1
Scaffold Graph/Node level:OC1CC2CCC3C4CCCCC4CCC23C1
Scaffold Graph level:CC1CC2CCC3C4CCCCC4CCC23C1
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like moleculesClass: Prenol lipids
Sub class: Sesquiterpenoids
Synonymous chemical names:agariblazeispirol c
External chemical identifiers:CID_12183453; NPATLAS_NPA005955; CHEMSPIDER_9432535; ZINC_ZINC000034430651
Chemical structure download