TPCN04917

Name 2??,3??,19??-trihydroxyolean-12-ene-24,28-dioic acid
Molecular Formula C30H46O7
Molecular Weight 518.69
CAS Registry Number 79355-89-8
SMILES CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C(=O)O)C5CCC43C)C2C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fagaceae Quercus robur Aerial parts 0.006500% Phytochem Anal 13, 305-310 (2002). 10.1002/pca.658
Properties
HBA 7 HBD 5
HeavyAtoms 37 AlogP 4.24
TPSA 135.29 RotatableBonds 2
FractionCSP3 0.87 Rings 5
AromaticRings 0 AliphaticRings 5