TPCN03948

Name Turrapubins K
Molecular Formula C36H46O16
Molecular Weight 734.75
CAS Registry Number 1438243-80-1
SMILES CC=C(C)C(=O)OC1CC(OC(=O)CC)C2(C(=O)OC)COC3C2C12COC(O)(C(=O)OC)C2C(C)(C12OC1(C)C1CC2OC2OC=CC21O)C3O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Meliaceae Turraea pubescens Stems 0.000250% J Nat Prod 76, 1166-1174 (2013). 10.1021/np400276q
Properties
HBA 16 HBD 3
HeavyAtoms 52 AlogP 0.19
TPSA 215.34 RotatableBonds 7
FractionCSP3 0.78 Rings 8
AromaticRings 0 AliphaticRings 8