TPCN03812

Name Longipedlactones H
Molecular Formula C30H40O7
Molecular Weight 512.64
CAS Registry Number 900783-89-3
SMILES C=C1C2CC3(O)C=C4C=CC(=O)OC(C)(C)C4C(O)CC3C2(C)CCC1(O)C(C)C1CC=C(C)C(=O)O1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Biebersteiniaceae Aesculus pavia Fruits 0.000571% Phytochemistry 67, 784-794 (2006). 10.1016/j.phytochem.2006.01.017
Properties
HBA 7 HBD 3
HeavyAtoms 37 AlogP 3.54
TPSA 113.29 RotatableBonds 2
FractionCSP3 0.67 Rings 5
AromaticRings 0 AliphaticRings 5