TPCN04105

Name 2??,3??-dihydroxy24-norurs-4(23),12-dien-28-oic acid
Molecular Formula C29H44O4
Molecular Weight 456.67
CAS Registry Number 242794-72-5
SMILES C=C1C(O)C(O)CC2(C)C1CCC1(C)C2CC=C2C3C(C)C(C)CCC3(C(=O)O)CCC21C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Trevesia palmata Leaves 0.000064% Nat Prod Res, 2019, 1-8. 10.1080/14786419.2019.1696797
Properties
HBA 4 HBD 3
HeavyAtoms 33 AlogP 5.59
TPSA 77.76 RotatableBonds 1
FractionCSP3 0.83 Rings 5
AromaticRings 0 AliphaticRings 5