Phyto4Health

Vitamin A Palmitate

Representations & DB's id

ChEBI: CHEBI:17616
ChEMBL: CHEMBL1675
PubChem: 5280531
IUPAC: [(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] hexadecanoate
Standard InChI: InChI=1S/C36H60O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-25-35(37)38-30-28-32(3)23-20-22-31(2)26-27-34-33(4)24-21-29-36(34,5)6/h20,22-23,26-28H,7-19,21,24-25,29-30H2,1-6H3/b23-20+,27-26+,31-22+,32-28+
Standard InChI Key: VYGQUTWHTHXGQB-FFHKNEKCSA-N
SMILES: CCCCCCCCCCCCCCCC(=O)OC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)C)C

Molecular propeties

AlogP: 11.54
Hydrogen bonds acceptors: 2
Hydrogen bonds donors: 0
Rotatable bonds: 20
Number of rings: 1
Molecular Weight: 524.46
Topological polar surface area: 26.3
Number of aromatic rings: 0
Fsp3: 0.694
Number of carbons: 36

Plant sources

Part of plant Plant name Ref.
PlantFagopyrum esculentum

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency39810.7 nMAldehyde dehydrogenase 1A1P00352
Potency50118.7 nMGuanine nucleotide-binding protein G(s), subunit alphaP63092