TPCN03751

Name Turrapubins G
Molecular Formula C34H44O9
Molecular Weight 596.72
CAS Registry Number 1438243-77-6
SMILES C=C1C(C2(C)C=CC(=O)C(C)(C)C2CC(=O)OC)C(OC(C)=O)C(OC(=O)C(C)CC)C2(C)C(c3ccoc3)CC3OC132
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Meliaceae Turraea pubescens Stems 0.000833% J Nat Prod 76, 1166-1174 (2013). 10.1021/np400276q
Properties
HBA 9 HBD 0
HeavyAtoms 43 AlogP 5.34
TPSA 121.64 RotatableBonds 8
FractionCSP3 0.65 Rings 5
AromaticRings 1 AliphaticRings 4