TPCN03566
Name | Dammar-24-ene-21,28-dioic acid, 3-[(3-O-??-D-glucopyranosyl-??-L-arabinopyranosyl)oxy]-21-hydroxy-, 21-(??-D-glucopyranosyl) ester, (3??,4??)- (9CI, ACI) |
Molecular Formula | C47H76O20 |
Molecular Weight | 961.11 |
CAS Registry Number | 914649-14-2 |
SMILES | CC(C)=CCCC(O)(C(=O)OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1CCC1C3(C)CCC(OC4OCC(O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C(C)(C(=O)O)C3CCC12C |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Cucurbitaceae | Gynostemma cardiospermum | Aerial parts | 0.002500% | J Nat Prod, 2006, 69, 1394-1398. | 10.1021/np0600898 |
Properties
HBA | 20 | HBD | 12 |
HeavyAtoms | 67 | AlogP | -0.79 |
TPSA | 332.28 | RotatableBonds | 13 |
FractionCSP3 | 0.91 | Rings | 7 |
AromaticRings | 0 | AliphaticRings | 7 |