TPCN06321

Name 3-O-??-D-xylopyranosyl-(1??2)-??-L-arabinopyranosyl gypsogenin
Molecular Formula C40H62O12
Molecular Weight 734.92
CAS Registry Number 905982-67-4
SMILES CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6OC6OCC(O)C(O)C6O)C(C)(C=O)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lardizabalaceae Akebia quinata Fruits 0.000040% Chem Pharm Bull (Tokyo) . 2006 May;54(5):595-7 10.1248/cpb.54.595
Properties
HBA 12 HBD 6
HeavyAtoms 52 AlogP 3.34
TPSA 192.44 RotatableBonds 6
FractionCSP3 0.90 Rings 7
AromaticRings 0 AliphaticRings 7