TPCN04533

Name Oleiferoside B
Molecular Formula C63H98O29
Molecular Weight 1319.45
CAS Registry Number 1811547-27-9
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)O)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 0.000344% Planta Med 80(7): 590-598. 10.1055/s-0034-1368428
Properties
HBA 29 HBD 15
HeavyAtoms 92 AlogP -2.65
TPSA 464.03 RotatableBonds 18
FractionCSP3 0.87 Rings 9
AromaticRings 0 AliphaticRings 9