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alpha-ribazole

MNXM1539 is deprecated and here replaced by MNXM729592
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM729592 Image of MNXM729592
referencechebi:10329
formulaC14H18N2O4
global charge0
mol weight278.308
InChIKeyHLRUKOJSWOKCPP-SYQHCUMBSA-N
InChIInChI=1S/C14H18N2O4/c1-7-3-9-10(4-8(7)2)16(6-15-9)14-13(19)12(18)11(5-17)20-14/h3-4,6,11-14,17-19H,5H2,1-2H3/t11-,12-,13-,14+/m1/s1
SMILESCC1=C(C)C=C2C(=C1)N=CN2[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C14H18N2O4/c1-7-3-9-10(4-8(7)2)16(6-15-9)14-13(19)12(18)11(5-17)20-14/h3-4,6,11-14,17-19H,5H2,1-2H3/t11-,12-,13-,14+/m1/s1 Image of MNXM729592
SMILES (mnx)[CH3:1][C:7]1=[CH:3][C:9]2=[C:10]([CH:4]=[C:8]1[CH3:2])[N:16]([C@@H:14]1[C@H:13]([OH:19])[C@H:12]([OH:18])[C@@H:11]([CH2:5][OH:17])[O:20]1)[CH:6]=[N:15]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:10329
chebi:10329
HLRUKOJSWOKCPP-SYQHCUMBSA-N 		alpha-ribazole
5,6-dimethyl-1-alpha-D-ribofuranosyl-1H-benzimidazole
N1-(alpha-D-ribosyl)-5,6-dimethylbenzimidazole
alpha-Ribazole

bigg.metabolite:rdmbzi
biggM:rdmbzi
vmhM:rdmbzi
vmhmetabolite:rdmbzi
HLRUKOJSWOKCPP-SYQHCUMBSA-N
HLRUKOJSWOKCPP-UHFFFAOYSA-N 		N1-(alpha-D-ribosyl)-5,6-dimethylbenzimidazole

kegg.compound:C05775
keggC:C05775
HLRUKOJSWOKCPP-SYQHCUMBSA-N 		alpha-Ribazole
N1-(alpha-D-Ribosyl)-5,6-dimethylbenzimidazole

seed.compound:cpd03423
seedM:cpd03423
HLRUKOJSWOKCPP-SYQHCUMBSA-N 		alpha-Ribazole
N1-(alpha-D-Ribosyl)-5,6-dimethylbenzimidazole
N1-(alpha-D-ribosyl)-5,6-dimethylbenzimidazole
alpha-ribazole
rdmbzi

sabiork.compound:8134
sabiorkM:8134
HLRUKOJSWOKCPP-SYQHCUMBSA-N 		alpha-Ribazole
N1-(alpha-D-ribosyl)-5,6-dimethylbenzimidazole

metacyc.compound:ALPHA-RIBAZOLE
metacycM:ALPHA-RIBAZOLE
HLRUKOJSWOKCPP-SYQHCUMBSA-N 		alpha-ribazole
N1-(alpha-D-ribosyl)-5,6-dimethylbenzimidazole

biggM:M_rdmbzi
keggC:M_C05775
seedM:M_cpd03423
vmhM:M_rdmbzi 		secondary/obsolete/fantasy identifier