TPCN03546

Name Cucurbitacin I
Molecular Formula C30H42O7
Molecular Weight 514.66
CAS Registry Number 2222-07-3
SMILES CC(C)(O)C=CC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(C=C(O)C(=O)C4(C)C)C3(C)C(=O)CC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Cucurbitaceae Citrullus colocynthis Fruits 0.002840% Chem Pharm Bull (Tokyo), 2007, 55, 428-434. 10.1248/cpb.55.428
Properties
HBA 7 HBD 4
HeavyAtoms 37 AlogP 3.62
TPSA 132.13 RotatableBonds 4
FractionCSP3 0.70 Rings 4
AromaticRings 0 AliphaticRings 4