TPCN06206

Name Taibaienoside VI
Molecular Formula C47H74O18
Molecular Weight 927.09
CAS Registry Number 91204-07-8
SMILES CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OCC(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Catunaregam tomentosa Roots 0.000250% Nat Prod Res . 2018 Jul;32(13):1499-1505 10.1080/14786419.2017.1385009
Properties
HBA 18 HBD 10
HeavyAtoms 65 AlogP 1.44
TPSA 291.82 RotatableBonds 9
FractionCSP3 0.91 Rings 8
AromaticRings 0 AliphaticRings 8