TPCN04749

Name Barringtogenol C 3-O-??-D-glucopyranoside
Molecular Formula C36H60O10
Molecular Weight 652.87
CAS Registry Number 57706-58-8
SMILES CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC(O)C2(CO)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Hydrocotyle nepalensis Whole plants 0.000060% Fitoterapia 110: 66-71. 10.1016/j.fitote.2016.02.003
Properties
HBA 10 HBD 8
HeavyAtoms 46 AlogP 1.88
TPSA 180.30 RotatableBonds 4
FractionCSP3 0.94 Rings 6
AromaticRings 0 AliphaticRings 6