TPCN05651

Name Brachyantheraoside B2
Molecular Formula C41H66O14
Molecular Weight 782.97
CAS Registry Number 2113695-55-7
SMILES CC1OC(OC2C(OCC3(C)C(O)CCC4(C)C3CCC3(C)C4CC=C4C5CC(C)(O)CCC5(C(=O)O)CCC43C)OC(CO)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lardizabalaceae Stauntonia chinensis Stems 0.000013% Nat Prod Res. 2019. 33, 1269-1276 10.1080/14786419.2018.1470515
Properties
HBA 14 HBD 9
HeavyAtoms 55 AlogP 1.61
TPSA 236.06 RotatableBonds 7
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7