TPCN03727

Name 3-O-??-D-ribopyranosyl-(1 ?? 3)-??-L-rhamnopyranosyl(1 ?? 2)-??-D-xylopyranosyl oleanolic acid
Molecular Formula C46H74O15
Molecular Weight 867.08
CAS Registry Number 96315-51-4
SMILES CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)O)CCC45C)C3(C)C)OCC(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Cassia sophera Seeds 0.000980% Nat Prod Res 21, 494-499 (2007). 10.1080/14786410601130042
Properties
HBA 15 HBD 8
HeavyAtoms 61 AlogP 3.01
TPSA 234.29 RotatableBonds 7
FractionCSP3 0.93 Rings 8
AromaticRings 0 AliphaticRings 8