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(Q50362394)
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English
5'-xanthylic acid
pair of stereoisomers
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Statements
instance of
type of chemical entity
0 references
subclass of
xanthosine 5'-phosphate
0 references
primary metabolite
1 reference
stated in
Reactome
reference URL
https://plantreactome.gramene.org/PathwayBrowser/#/R-OSA-2744345&DTAB=MT
Xanthosine-monophosphate
1 reference
based on heuristic
inferred from SMILES
part of
XMP metabolic process
subject has role
participant
1 reference
stated in
Gene Ontology release 2019-11-16
XMP biosynthetic process
subject has role
product
1 reference
stated in
Gene Ontology release 2019-11-16
XMP salvage
subject has role
product
1 reference
stated in
Gene Ontology release 2020-05-02
mass
364.042014626
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(2S,3S,4S,5S)-5-(2,6-dioxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Xanthosine monophosphate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₃N₄O₉P
0 references
canonical SMILES
O=P(O)(O)OCC1OC(N2C=NC=3C(O)=NC(O)=NC32)C(O)C1O
0 references
isomeric SMILES
O[C@@H]1[C@@H](COP(O)(O)=O)O[C@H]([C@@H]1O)n1cnc2c1[nH]c(=O)[nH]c2=O
0 references
found in taxon
Arabidopsis thaliana
1 reference
stated in
Plant purine nucleoside catabolism employs a guanosine deaminase required for the generation of xanthosine in Arabidopsis.
Homo sapiens
2 references
stated in
Recon 2.2: from reconstruction to model of human metabolism
stated in
A community-driven global reconstruction of human metabolism.
catalog
CAS COVID-19 Anti-Viral Candidate Compounds
0 references
Identifiers
InChI
InChI=1S/C10H13N4O9P/c15-5-3(1-22-24(19,20)21)23-9(6(5)16)14-2-11-4-7(14)12-10(18)13-8(4)17/h2-3,5-6,9,15-16H,1H2,(H2,19,20,21)(H2,12,13,17,18)/t3-,5-,6-,9-/m1/s1
0 references
InChIKey
DCTLYFZHFGENCW-UUOKFMHZSA-N
1 reference
stated in
ChEBI release 2020-09-01
CAS Registry Number
25249-23-4
1 reference
InChIKey
DCTLYFZHFGENCW-UUOKFMHZSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=25249-23-4
PubChem CID
73323
1 reference
matched by identifier from
InChIKey
InChIKey
DCTLYFZHFGENCW-UUOKFMHZSA-N
ChEBI ID
15652
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C10H13N4O9P/c15-5-3(1-22-24(19,20)21)23-9(6(5)16)14-2-11-4-7(14)12-10(18)13-8(4)17/h2-3,5-6,9,15-16H,1H2,(H2,19,20,21)(H2,12,13,17,18)/t3-,5-,6-,9-/m1/s1
SureChEMBL ID
SCHEMBL188739
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DCTLYFZHFGENCW-UUOKFMHZSA-N
SCHEMBL188740
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DCTLYFZHFGENCW-UUOKFMHZSA-N
UniChem compound ID
650613
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN-PR100212
0 references
MSBNK-RIKEN-PR100625
0 references
SPLASH
splash10-0ik9-7964000000-bce7ee60221f82790f35
0 references
splash10-02t9-1019000000-446eb96862b6d0d5d340
0 references
splash10-0002-9200000000-17ce2128bbb70c070402
0 references
splash10-0002-9200000000-4d5b101380293341d0c8
0 references
splash10-0002-9000000000-6144df3beed23d0845ad
0 references
splash10-0002-9100000000-4f30bfb083688c9985c3
0 references
splash10-0002-9100000000-b63d6af25c36cfd2bc89
0 references
splash10-03di-0009000000-d2ff59c992f751494f98
0 references
splash10-03di-0009000000-aae52e0f17a519aceffa
0 references
splash10-0002-9400000000-05c1ae772c001a15a8c6
0 references
DSSTox substance ID
DTXSID40948098
0 references
DTXSID20966674
1 reference
matched by identifier from
InChIKey
InChIKey
DCTLYFZHFGENCW-UUOKFMHZSA-N
DSSTOX compound identifier
DTXCID801376341
0 references
Human Metabolome Database ID
HMDB0001554
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DCTLYFZHFGENCW-UUOKFMHZSA-N
UNII
Y29K672ETF
1 reference
matched by identifier from
InChIKey
InChIKey
DCTLYFZHFGENCW-UUOKFMHZSA-N
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