TPCN04098

Name Turrapubins H
Molecular Formula C33H42O11
Molecular Weight 614.69
CAS Registry Number 1438243-78-7
SMILES C=C1C(C2(C)C=CC(=O)C(C)(C)C2CC(=O)OC)C(OC(C)=O)C(OC(=O)C(C)C)C2(C)C(C3=CC(O)OC3=O)CC3OC132
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Meliaceae Turraea pubescens Stems 0.000072% J Nat Prod 76, 1166-1174 (2013). 10.1021/np400276q
Properties
HBA 11 HBD 1
HeavyAtoms 44 AlogP 2.99
TPSA 155.03 RotatableBonds 7
FractionCSP3 0.67 Rings 5
AromaticRings 0 AliphaticRings 5