TPCN01951

Name 5
Molecular Formula C15H24O4
Molecular Weight 268.35
CAS Registry Number 442845-05-8
SMILES CC1=C2CC(C(O)(CO)CO)CCC2(C)CCC1=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Pseudoelephantopus spicatus Aerial parts 0.000040% Chem Pharm Bull (Tokyo) 54(11): 1599-1601.(2006) 10.1248/cpb.54.1599
Properties
HBA 4 HBD 3
HeavyAtoms 19 AlogP 1.19
TPSA 77.76 RotatableBonds 3
FractionCSP3 0.80 Rings 2
AromaticRings 0 AliphaticRings 2