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