all-trans-retinyl palmitate

Chemical Formula:

C₃₆H₆₀O₂

Molecular Weight:

524.869 Daltons

Monoisotopic Mass:

524.4593311702 Daltons

SMILES:

CCCCCCCCCCCCCCCC(OCC=C(C=CC=C(C=CC1(C(CCCC=1C)(C)C))C)C)=O

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

Synonyms

chocola A
aquasol A
vitamin A palmitate
retinol-palmitate

Databases

MetaCyc: CHOCOLA_A

HMDB: HMDB03648

LIPID MAPS: LMPR01090013

ChemSpider: 4444162

PubChem (CID): 5280531

ChEBI: 17616

KEGG: C02588

CAS: 79-81-2

RefMet: All-trans-retinyl palmitate all-trans-retinyl palmitate

Seed: cpd01691

MetaNetX: MNXM918