TPCN05733

Name 3-O-b-D-glucopyranosyl-28-O-(a-L-rhamnopyranosyl-(1 ? 3)[b-D-xylopyranosyl-(1 ? 4)]-b-D-xylopyranosyl-(1 ? 4)-a-L-rhamnopyranosyl-(1 ? 2)-a-L-arabinopyranosyl)-protobassicacid
Molecular Formula C63H102O31
Molecular Weight 1355.48
CAS Registry Number 857506-83-3
SMILES CC1OC(OC2C(OC3OCC(O)C(O)C3O)COC(OC3C(C)OC(OC4C(OC(=O)C56CCC(C)(C)CC5C5=CCC7C8(C)CC(O)C(OC9OC(CO)C(O)C(O)C9O)C(C)(CO)C8C(O)CC7(C)C5(C)CC6)OCC(O)C4O)C(O)C3O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Sapotaceae Sideroxylon foetidissimum Roots 0.001602% Phytochemistry. 2009 Apr;70(6):765-72. 10.1016/j.phytochem.2009.03.014.
Properties
HBA 31 HBD 18
HeavyAtoms 94 AlogP -5.50
TPSA 491.97 RotatableBonds 14
FractionCSP3 0.95 Rings 11
AromaticRings 0 AliphaticRings 11