Difference between revisions of "CPD-170"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=L-ARGININO-SUCCINATE L-ARGININO-SUCCINATE] == * smiles: ** C(NC(=[N+])NC(CC(=O)[O-])C(=O)[O-])C...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-170 CPD-170] == * smiles: ** C(O)C1(C(O)C(O)C(O)C(O1)OCC4(C(O)C(O)C(O)C(OCC3(C(O)C(O)C(O)C(...")
 
(2 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=L-ARGININO-SUCCINATE L-ARGININO-SUCCINATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-170 CPD-170] ==
 
* smiles:
 
* smiles:
−
** C(NC(=[N+])NC(CC(=O)[O-])C(=O)[O-])CCC(C(=O)[O-])[N+]
+
** C(O)C1(C(O)C(O)C(O)C(O1)OCC4(C(O)C(O)C(O)C(OCC3(C(O)C(O)C(O)C(OC2(CO)(C(O)C(O)C(CO)O2))O3))O4))
 
* inchi key:
 
* inchi key:
−
** InChIKey=KDZOASGQNOPSCU-ZBHICJROSA-M
+
** InChIKey=UQZIYBXSHAGNOE-XNSRJBNMSA-N
 
* common name:
 
* common name:
−
** L-arginino-succinate
+
** stachyose
 
* molecular weight:
 
* molecular weight:
−
** 289.267    
+
** 666.583    
 
* Synonym(s):
 
* Synonym(s):
−
** N-(L-arginino)-succinate
+
** (2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
−
** arginino-succinate
+
** α-D-Galp-(1->6)-α-D-Galp-(1->6)-α-D-Glcp-(1->2)-β-D-Fruf
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-11501]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[ARGSUCCINSYN-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[ARGSUCCINLYA-RXN]]
+
* [[2.4.1.67-RXN]]
 
== External links  ==
 
== External links  ==
−
* BIGG : 41790
+
* CAS : 10094-58-3
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46878376 46878376]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=439531 439531]
−
* HMDB : HMDB00052
+
* KEGG-GLYCAN : G00278
 +
* HMDB : HMDB03553
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C03406 C03406]
+
** [http://www.genome.jp/dbget-bin/www_bget?C01613 C01613]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.388624.html 388624]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57472 57472]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17164 17164]
−
* METABOLIGHTS : MTBLC57472
+
{{#set: smiles=C(O)C1(C(O)C(O)C(O)C(O1)OCC4(C(O)C(O)C(O)C(OCC3(C(O)C(O)C(O)C(OC2(CO)(C(O)C(O)C(CO)O2))O3))O4))}}
−
{{#set: smiles=C(NC(=[N+])NC(CC(=O)[O-])C(=O)[O-])CCC(C(=O)[O-])[N+]}}
+
{{#set: inchi key=InChIKey=UQZIYBXSHAGNOE-XNSRJBNMSA-N}}
−
{{#set: inchi key=InChIKey=KDZOASGQNOPSCU-ZBHICJROSA-M}}
+
{{#set: common name=stachyose}}
−
{{#set: common name=L-arginino-succinate}}
+
{{#set: molecular weight=666.583   }}
−
{{#set: molecular weight=289.267   }}
+
{{#set: common name=(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol|α-D-Galp-(1->6)-α-D-Galp-(1->6)-α-D-Glcp-(1->2)-β-D-Fruf}}
−
{{#set: common name=N-(L-arginino)-succinate|arginino-succinate}}
+
{{#set: consumed by=RXN-11501}}
−
{{#set: produced by=ARGSUCCINSYN-RXN}}
+
{{#set: reversible reaction associated=2.4.1.67-RXN}}
−
{{#set: consumed or produced by=ARGSUCCINLYA-RXN}}
+

Latest revision as of 20:43, 21 March 2018

Metabolite CPD-170

  • smiles:
    • C(O)C1(C(O)C(O)C(O)C(O1)OCC4(C(O)C(O)C(O)C(OCC3(C(O)C(O)C(O)C(OC2(CO)(C(O)C(O)C(CO)O2))O3))O4))
  • inchi key:
    • InChIKey=UQZIYBXSHAGNOE-XNSRJBNMSA-N
  • common name:
    • stachyose
  • molecular weight:
    • 666.583
  • Synonym(s):
    • (2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    • α-D-Galp-(1->6)-α-D-Galp-(1->6)-α-D-Glcp-(1->2)-β-D-Fruf

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 10094-58-3
  • PUBCHEM:
  • KEGG-GLYCAN : G00278
  • HMDB : HMDB03553
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:



{{#set: common name=(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol|α-D-Galp-(1->6)-α-D-Galp-(1->6)-α-D-Glcp-(1->2)-β-D-Fruf}}


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