Difference between revisions of "RXN0-6359"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3187 CPD-3187] == * smiles: ** C1(CCC(O)([N+](C)1)C2(=CN=CC=C2)) * inchi key: ** InChIKey=B...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=TREHALOSE TREHALOSE] == * smiles: ** C(C1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))O * inchi ke...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3187 CPD-3187] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=TREHALOSE TREHALOSE] ==
 
* smiles:
 
* smiles:
** C1(CCC(O)([N+](C)1)C2(=CN=CC=C2))
+
** C(C1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))O
 
* inchi key:
 
* inchi key:
** InChIKey=BOQRPPFUUSHFGW-SNVBAGLBSA-O
+
** InChIKey=HDTRYLNUVZCQOY-LIZSDCNHSA-N
 
* common name:
 
* common name:
** 2'-hydroxynicotine
+
** α,α-trehalose
 
* molecular weight:
 
* molecular weight:
** 179.241    
+
** 342.299    
 
* Synonym(s):
 
* Synonym(s):
 +
** α-D-glucopyranosyl α-D-glucopyranoside
 +
** α-D-Glcp-(1↔1)-α-D-Glcp
 +
** D-(+)-trehalose
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[TREHALA-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN66-146]]
+
* [[TREHALOSEPHOSPHA-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 99-20-7
 +
* BIGG : 36774
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245599 25245599]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7427 7427]
* HMDB : HMDB01329
+
* KEGG-GLYCAN : G00293
{{#set: smiles=C1(CCC(O)([N+](C)1)C2(=CN=CC=C2))}}
+
* HMDB : HMDB00975
{{#set: inchi key=InChIKey=BOQRPPFUUSHFGW-SNVBAGLBSA-O}}
+
* LIGAND-CPD:
{{#set: common name=2'-hydroxynicotine}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C01083 C01083]
{{#set: molecular weight=179.241   }}
+
* CHEMSPIDER:
{{#set: produced by=RXN66-146}}
+
** [http://www.chemspider.com/Chemical-Structure.7149.html 7149]
 +
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16551 16551]
 +
* METABOLIGHTS : MTBLC16551
 +
{{#set: smiles=C(C1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))O}}
 +
{{#set: inchi key=InChIKey=HDTRYLNUVZCQOY-LIZSDCNHSA-N}}
 +
{{#set: common name=α,α-trehalose}}
 +
{{#set: molecular weight=342.299   }}
 +
{{#set: common name=α-D-glucopyranosyl α-D-glucopyranoside|α-D-Glcp-(1↔1)-α-D-Glcp|D-(+)-trehalose}}
 +
{{#set: consumed by=TREHALA-RXN}}
 +
{{#set: produced by=TREHALOSEPHOSPHA-RXN}}

Revision as of 14:41, 21 March 2018

Metabolite TREHALOSE

  • smiles:
    • C(C1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))O
  • inchi key:
    • InChIKey=HDTRYLNUVZCQOY-LIZSDCNHSA-N
  • common name:
    • α,α-trehalose
  • molecular weight:
    • 342.299
  • Synonym(s):
    • α-D-glucopyranosyl α-D-glucopyranoside
    • α-D-Glcp-(1↔1)-α-D-Glcp
    • D-(+)-trehalose

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 99-20-7
  • BIGG : 36774
  • PUBCHEM:
  • KEGG-GLYCAN : G00293
  • HMDB : HMDB00975
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16551