TPCN06371

Name (23E)-12??,20(R),25(S),26-tetrahydroxydammar-23-en-3-one
Molecular Formula C31H52O5
Molecular Weight 504.75
CAS Registry Number 2480234-27-1
SMILES CC(C)(O)C(O)C=CCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(=O)C(C)(C)C3CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Juglandaceae Juglans mandshurica Fruits 0.000047% None 10.1080/14786419.2020.1818233
Properties
HBA 5 HBD 4
HeavyAtoms 36 AlogP 5.04
TPSA 97.99 RotatableBonds 5
FractionCSP3 0.90 Rings 4
AromaticRings 0 AliphaticRings 4