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9-cis-Retinyl Palmitate

PubChem CID: 13014097

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Compound Synonyms 9-cis-Retinyl Palmitate, 34356-29-1, 9-cis-Vitamin A Palmitate, [(2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] hexadecanoate, (2E,4E,6Z,8E)-3,7-Dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl palmitate, (9-cis)-Retinol Hexadecanoate, Retinol, 15-hexadecanoate, 9-cis-, Retinol, hexadecanoate, 9-cis- (9CI), Retinol, palmitate, 9-cis- (8CI), 9-cis-Retinyl palmitate, 9-cis-Vitamin A palmitate, 9-cis-Retinol Palmitate, starbld0005192, 9-cis-retinyl hexadecanoate, HY-N8356A, DTXSID50515210, CHEBI:138725, VYGQUTWHTHXGQB-UMNZIDCRSA-N, (9cis)-O(15)-hexadecanoylretinol, (9cis)-O~15~-Hexadecanoylretinol, AKOS040758060, FR27721, CS-0143536, (2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate
Topological Polar Surface Area 26.3
Hydrogen Bond Donor Count 0.0
Inchi Key VYGQUTWHTHXGQB-UMNZIDCRSA-N
Rotatable Bond Count 21.0
State Solid
Substituent Name Wax monoester skeleton, Retinoid skeleton, Diterpenoid, Fatty alcohol ester, Carboxylic acid ester, Monocarboxylic acid or derivatives, Ether, Carboxylic acid derivative, Hydrocarbon derivative, Organooxygen compound, Carbonyl group, Aliphatic homomonocyclic compound
Synonyms All-trans-retinol palmitate, all-trans-Retinyl hexadecanoate, all-trans-Retinyl hexadecanoic acid, All-trans-retinyl palmitate, all-trans-Retinyl palmitic acid, All-trans-vitamin a palmitate, Aquapalm, Aquasol a, Aquasol a (TN), Arovit, Arovit (roche), Axerophthol palmitate, Chocola a, Chocola_a, Del-vi-a, Dispatabs tabs, Ester found in fish liver oils, Lutavit A 500 Plus, O~15~-hexadecanoylretinol, O~15~-palmitoylretinol, Optovit a, Optovit-a, Palmitic acid, ester with retinol, Retinol palmitate, Retinol palmitate (6CI,7CI), Retinol palmitate (JP15), Retinol palmitic acid, Retinol-palmitate, Retinol, all-trans-, palmitate, Retinol, hexadecanoate, retinol, O~15~-(1-oxohexadecyl)-, Retinol, palmitate, all-trans-, Retinol, palmitate, all-trans- (8CI), Retinyl hexadecanoate, Retinyl hexadecanoic acid, Retinyl palmitate, Retinyl palmitic acid, Testavol s, Trans-retinol palmitate, Trans-retinyl palmitate, Vi-dom-a, Vitamin A palmitate, Vitamin a palmitic acid, Vitamin a solubilized, Vitamin- a palmitate, Vitazyme a
Heavy Atom Count 38.0
Pathway Kegg Map Id map00830
Compound Name 9-cis-Retinyl Palmitate
Kingdom Organic compounds
Description Nutrient, appearance control agent for colours and colour modifiers. Found in fish liver oils. Dietary supplement, permitted in infant formulas Palmitate is an antioxidant and a vitamin A compound added to low fat milk and other dairy products to replace the vitamin content lost through the removal of milk fat. Palmitate is attached to the alcohol form of vitamin A, retinol, in order to make vitamin A stable in milk.[citation needed], Retinyl palmitate is a synthetic alternate for retinyl acetate in vitamin A supplements, and is available in oily or dry forms. It is a common vitamin supplement, available in both oral and injectable forms for treatment of vitamin A deficiency, under the brand names Aquasol A, Palmitate A and many others. It is a pre-formed version of vitamin A, and can thus be realistically over-dosed, unlike beta-carotene., Retinyl palmitate, or vitamin A palmitate, is a common vitamin supplement, with formula C36H60O2. It is available in both oral and injectable forms for treatment of vitamin A deficiency, under the brand names Aquasol and Palmitate., Retinyl palmitate is an alternate for retinyl acetate in vitamin A supplements, and is available in oily or dry forms. It is a pre-formed version of vitamin A, and can thus be realistically over-dosed, unlike beta-carotene.
Exact Mass 524.459
Formal Charge 0.0
Monoisotopic Mass 524.459
Isotope Atom Count 0.0
Molecular Complexity 803.0
Hydrogen Bond Acceptor Count 2.0
Molecular Weight 524.9
Database Name fooddb_chem_all;pubchem
Covalent Unit Count 1.0
Enzyme Uniprot Id O75907, O95237, Q58HT5, Q6E213
Defined Atom Stereocenter Count 0.0
Iupac Name [(2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] hexadecanoate
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 4.0
Class Fatty Acyls
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+
Smiles CCCCCCCCCCCCCCCC(=O)OC/C=C(\C)/C=C/C=C(/C)\C=C\C1=C(CCCC1(C)C)C
Xlogp 13.6
Superclass Lipids and lipid-like molecules
Defined Bond Stereocenter Count 4.0
Subclass Fatty acid esters
Molecular Formula C36H60O2

  • 1. Outgoing r'ship FOUND_IN to/from Apium Graveolens (Plant) Rel Props:Source_db:fooddb_chem_all