TPCN05534
Name | ??-D-Glucopyranoside, (3??,6??,12??)-3,12-dihydroxy-6-(??-D-xylopyranosyloxy)dammar-24-en-20-yl 6-O-??-D-xylopyranosyl- (ACI) |
Molecular Formula | C46H78O17 |
Molecular Weight | 903.11 |
CAS Registry Number | 1150246-91-5 |
SMILES | CC(C)=CCCC(C)(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(OC3OCC(O)C(O)C3O)CC12C |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Araliaceae | Panax notoginseng | Roots | 0.000250% | J Asian Nat Prod Res. 2008. 10, 845-849. | 10.1080/10286020802144776 |
Properties
HBA | 17 | HBD | 11 |
HeavyAtoms | 63 | AlogP | 0.22 |
TPSA | 277.91 | RotatableBonds | 11 |
FractionCSP3 | 0.96 | Rings | 7 |
AromaticRings | 0 | AliphaticRings | 7 |