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1-(5-phospho-beta-D-ribosyl)-ATP

PropertiesImage
MNX_IDMNXM1371119 Image of MNXM1371119
referencechebi:73183
formulaC15H19N5O20P4
global charge-6
mol weight713.228
InChIKeyRKNHJBVBFHDXGR-KEOHHSTQSA-H
InChIInChI=1S/C15H25N5O20P4/c16-12-7-13(18-4-19(12)14-10(23)8(21)5(37-14)1-35-41(25,26)27)20(3-17-7)15-11(24)9(22)6(38-15)2-36-43(31,32)40-44(33,34)39-42(28,29)30/h3-6,8-11,14-16,21-24H,1-2H2,(H,31,32)(H,33,34)(H2,25,26,27)(H2,28,29,30)/p-6/t5-,6-,8-,9-,10-,11-,14-,15-/m1/s1
SMILESN=C1C2=C(N=CN1[C@@H]1O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]1O)N([C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O)C=N2
MNX internals
InChI (mnx)InChI=1/C15H25N5O20P4/c16-12-7-13(18-4-19(12)14-10(23)8(21)5(37-14)1-35-41(25,26)27)20(3-17-7)15-11(24)9(22)6(38-15)2-36-43(31,32)40-44(33,34)39-42(28,29)30/h3-6,8-11,14-16,21-24H,1-2H2,(H,31,32)(H,33,34)(H2,25,26,27)(H2,28,29,30)/b16-12?/t5-,6-,8-,9-,10-,11-,14-,15-/m1/s1 Image of MNXM1371119
SMILES (mnx)[CH2:1]([C@@H:5]1[C@@H:8]([OH:21])[C@@H:10]([OH:23])[C@H:14]([N:19]2[CH:4]=[N:18][C:13]3=[C:7]([C:12]2=[NH:16])[N:17]=[CH:3][N:20]3[C@H:15]2[C@H:11]([OH:24])[C@H:9]([OH:22])[C@@H:6]([CH2:2][O:36][P:43]([OH:31])(=[O:32])[O:40][P:44]([OH:33])(=[O:34])[O:39][P:42]([OH:28])([OH:29])=[O:30])[O:38]2)[O:37]1)[O:35][P:41]([OH:25])([OH:26])=[O:27]
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:73183
chebi:73183
RKNHJBVBFHDXGR-KEOHHSTQSA-H 		1-(5-phospho-beta-D-ribosyl)-ATP
1-(5-phospho-beta-D-ribosyl)-ATP(6-)

kegg.compound:C02739
keggC:C02739
RKNHJBVBFHDXGR-KEOHHSTQSA-N 		1-(5-Phospho-D-ribosyl)-ATP
1-(5-Phospho-beta-D-ribosyl)-ATP
1-(5-Phosphoribosyl)-ATP
N1-(5-Phospho-D-ribosyl)-ATP
Phosphoribosyl-ATP

CHEBI:73200
chebi:73200
RKNHJBVBFHDXGR-KEOHHSTQSA-N 		1-(5-phospho-beta-D-ribosyl)-ATP
1-(5-Phospho-D-ribosyl)-ATP
1-(5-Phosphoribosyl)-ATP
1-(5-phospho-beta-D-ribofuranosyl)adenosine 5'-(tetrahydrogen triphosphate)
N1-(5-Phospho-D-ribosyl)-ATP
Phosphoribosyl-ATP

metacyc.compound:PHOSPHORIBOSYL-ATP
metacycM:PHOSPHORIBOSYL-ATP
RKNHJBVBFHDXGR-KEOHHSTQSA-H 		1-(5-phospho-beta-D-ribosyl)-ATP
1-(5-phospho-D-ribosyl)-ATP
1-(5-phosphoribosyl)-ATP
5-phosphoribosyl-ATP
N1-(5-phospho-D-ribosyl)-ATP
phosphoribosyl-ATP
hmdb:HMDB0003665
RKNHJBVBFHDXGR-KEOHHSTQSA-N 		Phosphoribosyl-ATP
({[(2R,3S,4R,5R)-5-{1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]-6-iminopurin-9-yl}-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxyphosphonic acid
({[({[(2R,3S,4R,5R)-5-{1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]-6-imino-6,9-dihydro-1H-purin-9-yl}-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
1-(5-O-Phosphono-beta-D-ribofuranosyl)adenosine 5'-(tetrahydrogen triphosphate)
1-(5-Phospho-D-ribosyl)-ATP
1-(5-Phospho-b-D-ribosyl)-ATP
1-(5-Phospho-beta-D-ribosyl)-ATP
1-(5-Phosphoribosyl)-ATP
N-1-(5-Phosphoribosyl)adenosine 5'-triphosphate
N1-(5-Phospho-D-ribosyl)-ATP
Phosphoribosyl ATP
Phosphoribosyladenosine triphosphate

seed.compound:cpd01775
seedM:cpd01775
RKNHJBVBFHDXGR-KEOHHSTQSA-H 		Phosphoribosyl-ATP
1-(5-Phospho-D-ribosyl)-ATP
1-(5-Phospho-beta-D-ribosyl)-ATP
1-(5-Phosphoribosyl)-ATP
1-(5-phospho-D-ribosyl)-ATP
1-(5-phospho-beta-D-ribosyl)-ATP
1-(5-phosphoribosyl)-ATP
5-phosphoribosyl-ATP
N1-(5-Phospho-D-ribosyl)-ATP
N1-(5-phospho-D-ribosyl)-ATP
phosphoribosyl-ATP
prbatp

hmdb:HMDB03665
keggC:M_C02739
seedM:M_cpd01775 		secondary/obsolete/fantasy identifier