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5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole

MNXM1409 is deprecated and here replaced by MNXM728322
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM728322 Image of MNXM728322
referencechebi:58730
formulaC9H11N3O9P
global charge-3
mol weight336.173
InChIKeyJHLXDWGVSYMXPL-XVFCMESISA-K
InChIInChI=1S/C9H14N3O9P/c13-6-4(2-20-22(17,18)19)21-8(7(6)14)12-3-10-1-5(12)11-9(15)16/h1,3-4,6-8,11,13-14H,2H2,(H,15,16)(H2,17,18,19)/p-3/t4-,6-,7-,8-/m1/s1
SMILESO=C([O-])NC1=CN=CN1[C@@H]1O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C9H14N3O9P/c13-6-4(2-20-22(17,18)19)21-8(7(6)14)12-3-10-1-5(12)11-9(15)16/h1,3-4,6-8,11,13-14H,2H2,(H,15,16)(H2,17,18,19)/t4-,6-,7-,8-/m1/s1 Image of MNXM728322
SMILES (mnx)[CH:1]1=[C:5]([NH:11][C:9](=[O:15])[OH:16])[N:12]([C@H:8]2[C@H:7]([OH:14])[C@H:6]([OH:13])[C@@H:4]([CH2:2][O:20][P:22]([OH:17])([OH:18])=[O:19])[O:21]2)[CH:3]=[N:10]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58730
chebi:58730
JHLXDWGVSYMXPL-XVFCMESISA-K 		5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole
5-carboxylatoamino-1-(5-O-phosphonato-D-ribosyl)imidazole(3-)
N-carboxylato-1-(5-O-phosphonato-beta-D-ribofuranosyl)-1H-imidazol-5-amine

kegg.compound:C15667
keggC:C15667
JHLXDWGVSYMXPL-XVFCMESISA-N 		5-Carboxyamino-1-(5-phospho-D-ribosyl)imidazole

seed.compound:cpd25523
seedM:cpd25523
sabiork.compound:23298
sabiorkM:23298
JHLXDWGVSYMXPL-XVFCMESISA-K
JHLXDWGVSYMXPL-XVFCMESISA-N 		5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole

CHEBI:48000
chebi:48000
JHLXDWGVSYMXPL-XVFCMESISA-N 		5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole
N-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-5-amine

bigg.metabolite:5caiz
biggM:5caiz
JHLXDWGVSYMXPL-XVFCMESISA-K 		5-phosphoribosyl-5-carboxyaminoimidazole

seed.compound:cpd11310
seedM:cpd11310
JHLXDWGVSYMXPL-XVFCMESISA-K 		5-phosphoribosyl-5-carboxyaminoimidazole
5-Carboxyamino-1-(5-phospho-D-ribosyl)imidazole
5caiz
N5-CAIR
N5-carboxyaminoimidazole ribonucleotide

metacyc.compound:CPD0-181
metacycM:CPD0-181
JHLXDWGVSYMXPL-XVFCMESISA-K 		N5-carboxyaminoimidazole ribonucleotide
5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole
5-phosphoribosyl-5-carboxyaminoimidazole
N5-CAIR

biggM:M_5caiz
keggC:M_C15667
seedM:M_cpd11310
seedM:M_cpd25523 		secondary/obsolete/fantasy identifier