TPCN01280

Name 2,3-dihydroxycostic acid
Molecular Formula C15H22O4
Molecular Weight 266.34
CAS Registry Number 1012311-28-2
SMILES C=C(C(=O)O)C1CCC2(C)CC(O)C(O)C(=C)C2C1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Inula viscosa Leaves 0.000968% Nat Prod Res 21(9): 824-827.(2007) 10.1080/14786410701415681
Properties
HBA 4 HBD 3
HeavyAtoms 19 AlogP 1.73
TPSA 77.76 RotatableBonds 2
FractionCSP3 0.67 Rings 2
AromaticRings 0 AliphaticRings 2