Difference between revisions of "R5PDP"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18011 CPD-18011] == * smiles: ** C(C(OC1(OC(C(O)C(C1O)O)CO))COP([O-])([O-])=O)O * inchi key...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CELLOBIOSE CELLOBIOSE] == * smiles: ** C(C2(C(C(C(C(OC1(C(OC(C(C1O)O)O)CO))O2)O)O)O))O * inchi...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18011 CPD-18011] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CELLOBIOSE CELLOBIOSE] ==
 
* smiles:
 
* smiles:
** C(C(OC1(OC(C(O)C(C1O)O)CO))COP([O-])([O-])=O)O
+
** C(C2(C(C(C(C(OC1(C(OC(C(C1O)O)O)CO))O2)O)O)O))O
 
* inchi key:
 
* inchi key:
** InChIKey=PLJAVYDLNJODGD-NZJLWHDDSA-L
+
** InChIKey=GUBGYTABKSRVRQ-QRZGKKJRSA-N
 
* common name:
 
* common name:
** 2-O-(α-D-glucopyranosyl)-sn-glycerol 3-phosphate
+
** β-D-cellobiose
 
* molecular weight:
 
* molecular weight:
** 332.2    
+
** 342.299    
 
* Synonym(s):
 
* Synonym(s):
 +
** 4-O-β-D-glucopyranosyl-β-D-glucopyranose
 +
** β-D-glucosyl-(1→4)-β-D-glucose
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-10773]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-12305]]
 +
* [[3.2.1.91-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[2.4.1.213-RXN]]
 
 
== External links  ==
 
== External links  ==
 +
* CAS : 528-50-7
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658883 90658883]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=10712 10712]
 +
* HMDB : HMDB00055
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C06422 C06422]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.10261.html 10261]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87089 87089]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=36217 36217]
{{#set: smiles=C(C(OC1(OC(C(O)C(C1O)O)CO))COP([O-])([O-])=O)O}}
+
{{#set: smiles=C(C2(C(C(C(C(OC1(C(OC(C(C1O)O)O)CO))O2)O)O)O))O}}
{{#set: inchi key=InChIKey=PLJAVYDLNJODGD-NZJLWHDDSA-L}}
+
{{#set: inchi key=InChIKey=GUBGYTABKSRVRQ-QRZGKKJRSA-N}}
{{#set: common name=2-O-(α-D-glucopyranosyl)-sn-glycerol 3-phosphate}}
+
{{#set: common name=β-D-cellobiose}}
{{#set: molecular weight=332.2    }}
+
{{#set: molecular weight=342.299    }}
{{#set: consumed or produced by=2.4.1.213-RXN}}
+
{{#set: common name=4-O-β-D-glucopyranosyl-β-D-glucopyranose|β-D-glucosyl-(1→4)-β-D-glucose}}
 +
{{#set: consumed by=RXN-10773}}
 +
{{#set: produced by=RXN-12305|3.2.1.91-RXN}}

Revision as of 19:10, 18 March 2018

Metabolite CELLOBIOSE

  • smiles:
    • C(C2(C(C(C(C(OC1(C(OC(C(C1O)O)O)CO))O2)O)O)O))O
  • inchi key:
    • InChIKey=GUBGYTABKSRVRQ-QRZGKKJRSA-N
  • common name:
    • β-D-cellobiose
  • molecular weight:
    • 342.299
  • Synonym(s):
    • 4-O-β-D-glucopyranosyl-β-D-glucopyranose
    • β-D-glucosyl-(1→4)-β-D-glucose

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links