TPCN03868

Name Psychotrianoside G
Molecular Formula C35H56O8
Molecular Weight 604.83
CAS Registry Number 111661-39-3
SMILES CC1(C=O)CCC23COC4(CCC5C6(C)CCC(OC7OCC(O)C(O)C7O)C(C)(C)C6CCC5(C)C4(C)CC2O)C3C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Buxaceae Buxus microphylla Aerial parts 0.000429% J Nat Prod, 2009, 72, 308-311. 10.1021/np800719h
Properties
HBA 8 HBD 4
HeavyAtoms 43 AlogP 3.99
TPSA 125.68 RotatableBonds 3
FractionCSP3 0.97 Rings 7
AromaticRings 0 AliphaticRings 7