TPCN04637

Name Oleiferoside D
Molecular Formula C64H98O29
Molecular Weight 1331.46
CAS Registry Number 1811547-28-0
SMILES CC=C(C)C(=O)OC1C(OC(=O)C(C)=CC)C2(CO)C(CC1(C)C)C1=CCC3C4(C)CCC(OC5OC(C(=O)OC)C(O)C(OC6OC(CO)C(O)C(O)C6OC6OCC(O)C(O)C6O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C=O)C4CCC3(C)C1(C)C(O)C2O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Theaceae Camellia oleifera Roots 0.000161% Planta Med 80(7): 590-598. 10.1055/s-0034-1368428
Properties
HBA 29 HBD 14
HeavyAtoms 93 AlogP -2.65
TPSA 453.03 RotatableBonds 17
FractionCSP3 0.84 Rings 9
AromaticRings 0 AliphaticRings 9