TPCN02037

Name Triptersinines C
Molecular Formula C34H39NO11
Molecular Weight 637.68
CAS Registry Number 1416246-16-6
SMILES CC(=O)OCC12C(OC(=O)C=Cc3ccccc3)CCC(C)(O)C13OC(C)(C)C(C(OC(C)=O)C2OC(=O)c1cccnc1)C3O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Tripterygium wilfordii Leaves 0.000011% J Nat Prod 76(1): 85-90.(2013) 10.1021/np300759u
Properties
HBA 12 HBD 2
HeavyAtoms 46 AlogP 2.80
TPSA 167.78 RotatableBonds 8
FractionCSP3 0.50 Rings 5
AromaticRings 2 AliphaticRings 3