TPCN03179

Name Gnidilatidin 20-palmitate
Molecular Formula C53H74O11
Molecular Weight 887.16
CAS Registry Number 60195-68-8
SMILES C=C(C)C12OC3(C=CC=CCCCCC)OC1C1C4OC4(COC(=O)CCCCCCCCCCCCCCC)C(O)C4(O)C(=O)C(C)=CC4C1(O3)C(C)C2OC(=O)c1ccccc1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Thymelaeaceae Daphne genkwa Buds 0.000034% Nat Prod Res 29, 1878-1883 (2015). 10.1080/14786419.2015.1009459
Properties
HBA 11 HBD 2
HeavyAtoms 64 AlogP 9.74
TPSA 150.35 RotatableBonds 25
FractionCSP3 0.68 Rings 7
AromaticRings 1 AliphaticRings 6