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4-OH-Retinal

PropertiesImage
MNX_IDMNXM37693 Image of MNXM37693
referencechebi:191486
formulaC20H28O2
global charge0
mol weight300.442
InChIKeyNCIHLRCJOBKKAL-ZBSJWCJSSA-N
InChIInChI=1S/C20H28O2/c1-15(7-6-8-16(2)13-14-21)9-11-18-17(3)10-12-19(22)20(18,4)5/h6-9,11,13-14,19,22H,10,12H2,1-5H3/b8-6+,11-9+,15-7+,16-13+
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)C(O)CC1
MNX internals
InChI (mnx)InChI=1/C20H28O2/c1-15(7-6-8-16(2)13-14-21)9-11-18-17(3)10-12-19(22)20(18,4)5/h6-9,11,13-14,19,22H,10,12H2,1-5H3/b8-6+,11-9+,15-7+,16-13+/t19? Image of MNXM37693
SMILES (mnx)[CH3:1][C:15](=[CH:7]\[CH:6]=[CH:8]\[C:16]([CH3:2])=[CH:13]\[CH:14]=[O:21])/[CH:9]=[CH:11]/[C:18]1=[C:17]([CH3:3])[CH2:10][CH2:12][CH:19]([OH:22])[C:20]1([CH3:4])[CH3:5]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:191486
chebi:191486
NCIHLRCJOBKKAL-ZBSJWCJSSA-N 		4-OH-Retinal
(2E,4E,6E,8E)-9-(5-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenal
hmdb:HMDB0012788
NCIHLRCJOBKKAL-ZBSJWCJSSA-N 		4-OH-Retinal
(2E,4E,6E,8E)-9-(5-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenal
3,7-Dimethyl-9-(5-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-all-trans-2,4,6,8-nonatetraen-1-ol
4-OH-all-trans-Retinal
4OHVA

bigg.metabolite:CE5593
biggM:CE5593
NCIHLRCJOBKKAL-ZBSJWCJSSA-N 		4-OH-retinal

vmhM:CE5593
vmhmetabolite:CE5593
NCIHLRCJOBKKAL-ZBSJWCJSSA-N 		4-OH-retinal
(2E,4E,6E,8E)-9-(5-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenal

hmdb:HMDB12788
biggM:M_CE5593
vmhM:M_CE5593 		secondary/obsolete/fantasy identifier