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All-trans-Retinyl palmitate

MNXM918 is deprecated and here replaced by MNXM1137720
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1137720 Image of MNXM1137720
referencebiggM:retpalm
formulaC36H60O2
global charge0
mol weight524.874
InChIKeyVYGQUTWHTHXGQB-UHFFFAOYSA-N
InChIInChI=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
SMILESCCCCCCCCCCCCCCCC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C
MNX internals
InChI (mnx)InChI=1/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? Image of MNXM1137720
SMILES (mnx)[CH3:1][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:25][C:35](=[O:37])[O:38][CH2:30][CH:28]=[C:32]([CH3:3])[CH:23]=[CH:20][CH:22]=[C:31]([CH3:2])[CH:26]=[CH:27][C:34]1=[C:33]([CH3:4])[CH2:24][CH2:21][CH2:29][C:36]1([CH3:5])[CH3:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:retpalm
biggM:retpalm
VYGQUTWHTHXGQB-UHFFFAOYSA-N 		All-trans-Retinyl palmitate
hmdb:HMDB0243575
VYGQUTWHTHXGQB-UHFFFAOYSA-N 		[3,7-Dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] hexadecanoate
(2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl palmitic acid
3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate

biggM:M_retpalm 		secondary/obsolete/fantasy identifier