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nicotinate beta-D-ribonucleotide

MNXM194 is deprecated and here replaced by MNXM1108016
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1108016 Image of MNXM1108016
referencechebi:57502
formulaC11H12NO9P
global charge-2
mol weight333.189
InChIKeyJOUIQRNQJGXQDC-ZYUZMQFOSA-L
InChIInChI=1S/C11H14NO9P/c13-8-7(5-20-22(17,18)19)21-10(9(8)14)12-3-1-2-6(4-12)11(15)16/h1-4,7-10,13-14H,5H2,(H2-,15,16,17,18,19)/p-2/t7-,8-,9-,10-/m1/s1
SMILESO=C([O-])C1=CC=C[N+]([C@@H]2O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]2O)=C1
MNX internals
InChI (mnx)InChI=1/C11H14NO9P/c13-8-7(5-20-22(17,18)19)21-10(9(8)14)12-3-1-2-6(4-12)11(15)16/h1-4,7-10,13-14H,5H2,(H2-,15,16,17,18,19)/t7-,8-,9-,10-/m1/s1 Image of MNXM1108016
SMILES (mnx)[CH:1]1=[CH:2][C:6]([C:11](=[O:15])[OH:16])=[CH:4][N+:12]([C@H:10]2[C@H:9]([OH:14])[C@H:8]([OH:13])[C@@H:7]([CH2:5][O:20][P:22]([OH:17])([O-:18])=[O:19])[O:21]2)=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)31
in models (compartimentalized) 22
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57502
chebi:57502
JOUIQRNQJGXQDC-ZYUZMQFOSA-L 		nicotinate beta-D-ribonucleotide
1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridinium-3-carboxylate
3-carboxylato-1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridinium
nicotinate D-ribonucleotide dianion
nicotinate D-ribonucleotide(2-)

bigg.metabolite:nicrnt
biggM:nicrnt
JOUIQRNQJGXQDC-ZYUZMQFOSA-L 		Nicotinate D-ribonucleotide

vmhM:nicrnt
vmhmetabolite:nicrnt
JOUIQRNQJGXQDC-ZYUZMQFOSA-L 		Nicotinate D-ribonucleotide
3-carboxy-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]-1lambda5-pyridin-1-ylium

sabiork.compound:5427
sabiorkM:5427
kegg.compound:C01185
keggC:C01185
JOUIQRNQJGXQDC-ZYUZMQFOSA-O 		Nicotinate D-ribonucleotide
Nicotinate ribonucleotide
Nicotinic acid ribonucleotide
beta-Nicotinate D-ribonucleotide

seed.compound:cpd00873
seedM:cpd00873
JOUIQRNQJGXQDC-ZYUZMQFOSA-L 		Nicotinate ribonucleotide
NaMN
Nicotinate D-ribonucleotide
NicotinateD-ribonucleotide
Nicotinic acid ribonucleotide
beta-Nicotinate D-ribonucleotide
beta-nicotinate D-ribonucleotide
beta-nicotinate-D-nucleotide
deamido-NMN
deamido-nicotinamide mononucleotide
nicotinate D-ribonucleotide
nicotinate dinucleotide
nicotinate mononucleotide
nicotinate nucleotide
nicotinate ribonucleotide
nicotinate-D-ribonucleotide
nicotinic acid mononucleotide
nicotinic acid nucleotide
nicotinic acid ribonucleotide
nicrnt

sabiork.compound:26792
sabiorkM:26792
JOUIQRNQJGXQDC-ZYUZMQFOSA-O 		Nicotinic acid mononucleotide
hmdb:HMDB0001132
JOUIQRNQJGXQDC-ZYUZMQFOSA-O 		Nicotinic acid mononucleotide
3-carboxy-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]-1lambda5-pyridin-1-ylium
Deamido nicotinamide ribonucleotide
Deamido-NMN
Nicotinate D-ribonucleotide
Nicotinate b-D-ribonucleotide
Nicotinate beta-D-ribonucleotide
Nicotinate mononucleotide
Nicotinate ribonucleotide
Nicotinic acid D-ribonucleotide
Nicotinic acid b-D-ribonucleotide
Nicotinic acid beta-D-ribonucleotide
Nicotinic acid ribonucleotide
Nicotinic acid ribotide
Nicotinic mononucleotide
b-Nicotinate D-ribonucleotide
b-Nicotinic acid D-ribonucleotide
beta-Nicotinate D-ribonucleotide
beta-Nicotinic acid D-ribonucleotide
beta-Nicotinic acid mononucleotide

metacyc.compound:NICOTINATE_NUCLEOTIDE
metacycM:NICOTINATE_NUCLEOTIDE
JOUIQRNQJGXQDC-ZYUZMQFOSA-L 		beta-nicotinate D-ribonucleotide
NaMN
beta-nicotinate-D-nucleotide
deamido-NMN
deamido-nicotinamide mononucleotide
nicotinate D-ribonucleotide
nicotinate dinucleotide
nicotinate mononucleotide
nicotinate nucleotide
nicotinate ribonucleotide
nicotinate-D-ribonucleotide
nicotinic acid mononucleotide
nicotinic acid nucleotide
nicotinic acid ribonucleotide

reactome:R-ALL-197220
reactomeM:R-ALL-197220
reactome:R-ALL-200492
reactomeM:R-ALL-200492
reactome:R-ALL-8938083
reactomeM:R-ALL-8938083
CHEBI:15763
chebi:15763
JOUIQRNQJGXQDC-ZYUZMQFOSA-O 		nicotinic acid D-ribonucleotide
3-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium
Nicotinate D-ribonucleotide
Nicotinate ribonucleotide
Nicotinic acid ribonucleotide
beta-Nicotinate D-ribonucleotide

hmdb:HMDB0059646
hmdb:HMDB01132
hmdb:HMDB59646
chebi:12398
chebi:14651
chebi:14652
chebi:25532
chebi:7561
biggM:M_nicrnt
keggC:M_C01185
seedM:M_cpd00873
vmhM:M_nicrnt 		secondary/obsolete/fantasy identifier