TPCN00911

Name Sclerocarpic acid
Molecular Formula C15H22O2
Molecular Weight 234.34
CAS Registry Number 225782-62-7
SMILES CC1(C)CCCC2CC3CC21CC=C3C(=O)O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Glyptopetalum sclerocarpum Barks 0.011000% Planta Med 65(3): 257-258.(1999) 10.1055/s-2006-960472
Properties
HBA 2 HBD 1
HeavyAtoms 17 AlogP 3.62
TPSA 37.30 RotatableBonds 1
FractionCSP3 0.80 Rings 3
AromaticRings 0 AliphaticRings 3