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all-trans-10'-apo-beta-carotenal

PropertiesImage
MNX_IDMNXM116056 Image of MNXM116056
referencechebi:53153
formulaC27H36O
global charge0
mol weight376.584
InChIKeyPJEHRCCPERVGEC-FLHUAPOTSA-N
InChIInChI=1S/C27H36O/c1-22(12-7-8-13-23(2)16-11-21-28)14-9-15-24(3)18-19-26-25(4)17-10-20-27(26,5)6/h7-9,11-16,18-19,21H,10,17,20H2,1-6H3/b8-7+,14-9+,16-11+,19-18+,22-12+,23-13+,24-15+
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=O)C(C)(C)CCC1
MNX internals
InChI (mnx)InChI=1/C27H36O/c1-22(12-7-8-13-23(2)16-11-21-28)14-9-15-24(3)18-19-26-25(4)17-10-20-27(26,5)6/h7-9,11-16,18-19,21H,10,17,20H2,1-6H3/b8-7+,14-9+,16-11+,19-18+,22-12+,23-13+,24-15+ Image of MNXM116056
SMILES (mnx)[CH3:1][C:22](=[CH:12]\[CH:7]=[CH:8]\[CH:13]=[C:23]([CH3:2])\[CH:16]=[CH:11]\[CH:21]=[O:28])/[CH:14]=[CH:9]/[CH:15]=[C:24]([CH3:3])/[CH:18]=[CH:19]/[C:26]1=[C:25]([CH3:4])[CH2:17][CH2:10][CH2:20][C:27]1([CH3:5])[CH3:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-5164383
reactomeM:R-ALL-5164383
CHEBI:53153
chebi:53153
PJEHRCCPERVGEC-FLHUAPOTSA-N 		all-trans-10'-apo-beta-carotenal
10'-Apo-beta,psi-carotenal
10'-apo-beta-caroten-10'-al
10'-apo-beta-carotenal
hmdb:HMDB0059605
PJEHRCCPERVGEC-FLHUAPOTSA-N 		10'-Apo-beta-carotenal
(2E,4E,6E,8E,10E,12E,14E)-4,9,13-trimethyl-15-(2,6,6-trimethylcyclohex-1-en-1-yl)pentadeca-2,4,6,8,10,12,14-heptaenal
10'-Apo-b-carotenal
10'-Apo-beta,psi-carotenal
10'-Apo-beta-caroten-10'-al
10'-apo-beta-carotenal
all-trans-10'-Apo-b-carotenal
all-trans-10'-Apo-beta-carotenal
beta-Apo-10'-carotenal

sabiork.compound:28314
sabiorkM:28314
PJEHRCCPERVGEC-FLHUAPOTSA-N 		10'-apo-beta-Carotenal

kegg.compound:C20695
keggC:C20695
PJEHRCCPERVGEC-FLHUAPOTSA-N 		all-trans-10'-Apo-beta-carotenal

metacyc.compound:CPD-13368
metacycM:CPD-13368
SLM:000598040
slm:000598040
PJEHRCCPERVGEC-FLHUAPOTSA-N 		all-trans-10'-apo-beta-carotenal

lipidmaps:LMPR01071053
lipidmapsM:LMPR01071053
PJEHRCCPERVGEC-FLHUAPOTSA-N 		beta-Apo-10'-carotenal
10'-Apo-beta-caroten-10'-al
10'-Apo-beta-carotenal

seed.compound:cpd23843
seedM:cpd23843
PJEHRCCPERVGEC-FLHUAPOTSA-N 		beta-apo-10'-carotenal
all-trans-10'-Apo-beta-carotenal
all-trans-10'-apo-beta-carotenal

hmdb:HMDB0036887
hmdb:HMDB36887
hmdb:HMDB59605
keggC:M_C20695
seedM:M_cpd23843 		secondary/obsolete/fantasy identifier