TPCN03161

Name Tasumatrol W
Molecular Formula C31H36O12
Molecular Weight 600.62
CAS Registry Number 1013025-35-8
SMILES CC(=O)OCC12C(O)CC3OCC3(OC(C)=O)C1C(OC(=O)c1ccccc1)C13CC(O)C(C)=C1C2(O)C(=O)OC3(C)C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Taxaceae Taxus sumatrana Aerial parts 0.000039% J Nat Prod 71, 576-580 (2008). 10.1021/np078016r
Properties
HBA 12 HBD 3
HeavyAtoms 43 AlogP 0.99
TPSA 175.12 RotatableBonds 5
FractionCSP3 0.61 Rings 6
AromaticRings 1 AliphaticRings 5