TPCN05455

Name 3-O-??-D-Xylopyranosyl-(1?2)-??-D-glucopyranosyl-12??,30-dihydroxy-olean-28,13??-olide
Molecular Formula C41H66O14
Molecular Weight 782.97
CAS Registry Number 1350742-49-2
SMILES CC1(CO)CCC23CCC4(C)C5(C)CCC6C(C)(C)C(OC7OC(CO)C(O)C(O)C7OC7OCC(O)C(O)C7O)CCC6(C)C5CC(O)C4(OC2=O)C3C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caprifoliaceae Patrinia scabiosaefolia Whole plants 0.000664% Carbohydr Res. 2011. 346, 2881-2885. 10.1016/j.carres.2011.10.008
Properties
HBA 14 HBD 8
HeavyAtoms 55 AlogP 1.14
TPSA 225.06 RotatableBonds 6
FractionCSP3 0.98 Rings 8
AromaticRings 0 AliphaticRings 8