TPCN05870

Name Swietesenin
Molecular Formula C36H56O12
Molecular Weight 680.83
CAS Registry Number 2618571-80-3
SMILES CC12CCC3C4(C)C=CC(=O)C(C)(CO)C4CC(OC4OC(CO)C(O)C(O)C4O)C3(C)C1=CCC2C1COC(O)(C(C)(C)O)C(O)C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Meliaceae Swietenia macrophylla Fruits 0.000035% Fitoterapia. 2018 Mar;125:141-146. 10.1016/j.fitote.2018.01.004.
Properties
HBA 12 HBD 8
HeavyAtoms 48 AlogP 0.56
TPSA 206.60 RotatableBonds 6
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6