TPCN04473

Name Scheffoleoside A;3-b-[(b-D-glucopyranosyl-(1 ! 2)-O-[b-D-glucopyranosyl-(1 ! 3)-O-]-a-L-arabinopyranosyl)oxy]-olean-12-en-28-oic acid
Molecular Formula C48H78O19
Molecular Weight 959.13
CAS Registry Number 160669-23-8
SMILES CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CC(O)C(O)C(C)(CO)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lardizabalaceae Akebia trifoliata Peels 0.020250% Chem Pharm Bull (Tokyo) . 2012;60(10):1264-74 10.1248/cpb.c12-00448
Lardizabalaceae Akebia trifoliata Stems 0.000900% Phytochemistry. 2006. 67, 2697-2705. 10.1016/j.phytochem.2006.09.003.
Apiaceae Centella asiatica Aerial parts 0.000500% Chem Pharm Bull (Tokyo) 49(10): 1368-1371. 10.1248/cpb.49.1368
Lardizabalaceae Akebia trifoliata Stems 0.000400% Phytochemistry. 2006. 67, 2697-2705. 10.1016/j.phytochem.2006.09.003.
Properties
HBA 19 HBD 12
HeavyAtoms 67 AlogP -0.89
TPSA 315.21 RotatableBonds 9
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8