Marvin  10130718302D          

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M  END
> <ID>
CHEBI:17616

> <NAME>
all-trans-retinyl palmitate

> <DEFINITION>
An all-trans-retinyl ester obtained by formal condensation of the carboxy group of palmitic (hexadecanoic acid) with the hydroxy group of all-trans-retinol. It is used in cosmetic products to treat various skin disorders such as acne, skin aging, wrinkles, dark spots, and also protect against psoriasis.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:8819; CHEBI:12784; CHEBI:26542

> <SYNONYM>
vitamin A palmitate; trans-retinyl palmitate; trans-retinol palmitate; retinyl palmitate; retinyl hexadecanoate; retinol palmitate; retinol hexadecanoate; O(15)-hexadecanoylretinol; all-trans-retinyl palmitate; all-trans-retinyl hexadecanoate; all-trans-retinol palmitate; (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-cyclohex-1-enyl)-nona-2,4,6,8,tetraenyl hexadecanoic acid ester; (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl hexadecanoate

> <IUPAC_NAME>
(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate

> <BRAND_NAME>
Optovit-A; Chocola A; Arovit; Aquasol A; Alphalin; Afaxin

> <FORMULA>
C36H60O2

> <MASS>
524.86040

> <MONOISOTOPIC_MASS>
524.45933

> <CHARGE>
0

> <SMILES>
CCCCCCCCCCCCCCCC(=O)OC\C=C(C)\C=C\C=C(C)\C=C\C1=C(C)CCCC1(C)C

> <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+

> <INCHIKEY>
VYGQUTWHTHXGQB-FFHKNEKCSA-N

> <CAS_REGISTRY_NUMBER>
79-81-2

> <REAXYS_REGISTRY_NUMBER>
1917366

> <CHEMIDPLUS>
79-81-2

> <DRUGBANK_ACCESSION>
DBSALT000855

> <KEGG_COMPOUND_ACCESSION>
C02588

> <KEGG_DRUG_ACCESSION>
D00164

> <LIPID_MAPS_INSTANCE_ACCESSION>
LMPR01090013

> <METACYC_ACCESSION>
CHOCOLA_A

> <NIST_CHEMISTRY_WEBBOOK>
79-81-2

> <WIKIPEDIA_ACCESSION>
Retinyl_palmitate

> <PUBMED_CITATION>
11236082; 16149731; 23290361; 23651513; 23945125; 24657715; 24998947; 26224426; 29025343; 29363259; 29412915; 29571474; 30031321; 30316701; 30551390; 30972178; 31369745; 32353979; 32846153; 33202630; 33290311; 33621371; 33658762; 8157860; 8359391; 9125314; 9380354

$$$$