Difference between revisions of "Ec-01 008630"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=1-KETO-2-METHYLVALERATE 1-KETO-2-METHYLVALERATE] == * smiles: ** CCC(O)(C)C(C([O-])=O)O * inchi...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MANNITOL-1P MANNITOL-1P] == * smiles: ** C(C(C(C(C(COP([O-])([O-])=O)O)O)O)O)O * inchi key: **...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=1-KETO-2-METHYLVALERATE 1-KETO-2-METHYLVALERATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MANNITOL-1P MANNITOL-1P] ==
 
* smiles:
 
* smiles:
** CCC(O)(C)C(C([O-])=O)O
+
** C(C(C(C(C(COP([O-])([O-])=O)O)O)O)O)O
 
* inchi key:
 
* inchi key:
** InChIKey=PDGXJDXVGMHUIR-UJURSFKZSA-M
+
** InChIKey=GACTWZZMVMUKNG-KVTDHHQDSA-L
 
* common name:
 
* common name:
** (R)-2,3-dihydroxy-3-methylpentanoate
+
** D-mannitol 1-phosphate
 
* molecular weight:
 
* molecular weight:
** 147.15    
+
** 260.137    
 
* Synonym(s):
 
* Synonym(s):
** (R)-2,3-dihydroxy-3-methylvalerate
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** mannitol-1-P
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[DIHYDROXYMETVALDEHYDRAT-RXN]]
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* [[MANNITOL-1-PHOSPHATASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[ACETOOHBUTREDUCTOISOM-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[MANNPDEHYDROG-RXN]]
 
== External links  ==
 
== External links  ==
 +
* CAS : 15806-48-1
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=21145376 21145376]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=23615341 23615341]
* HMDB : HMDB12140
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* HMDB : HMDB01530
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C06007 C06007]
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** [http://www.genome.jp/dbget-bin/www_bget?C00644 C00644]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.13641636.html 13641636]
+
** [http://www.chemspider.com/Chemical-Structure.19951338.html 19951338]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=49258 49258]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61381 61381]
* BIGG : 43150
+
* BIGG : 35604
{{#set: smiles=CCC(O)(C)C(C([O-])=O)O}}
+
{{#set: smiles=C(C(C(C(C(COP([O-])([O-])=O)O)O)O)O)O}}
{{#set: inchi key=InChIKey=PDGXJDXVGMHUIR-UJURSFKZSA-M}}
+
{{#set: inchi key=InChIKey=GACTWZZMVMUKNG-KVTDHHQDSA-L}}
{{#set: common name=(R)-2,3-dihydroxy-3-methylpentanoate}}
+
{{#set: common name=D-mannitol 1-phosphate}}
{{#set: molecular weight=147.15   }}
+
{{#set: molecular weight=260.137   }}
{{#set: common name=(R)-2,3-dihydroxy-3-methylvalerate}}
+
{{#set: common name=mannitol-1-P}}
{{#set: consumed by=DIHYDROXYMETVALDEHYDRAT-RXN}}
+
{{#set: consumed by=MANNITOL-1-PHOSPHATASE-RXN}}
{{#set: produced by=ACETOOHBUTREDUCTOISOM-RXN}}
+
{{#set: reversible reaction associated=MANNPDEHYDROG-RXN}}

Revision as of 22:54, 17 March 2018

Metabolite MANNITOL-1P

  • smiles:
    • C(C(C(C(C(COP([O-])([O-])=O)O)O)O)O)O
  • inchi key:
    • InChIKey=GACTWZZMVMUKNG-KVTDHHQDSA-L
  • common name:
    • D-mannitol 1-phosphate
  • molecular weight:
    • 260.137
  • Synonym(s):
    • mannitol-1-P

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C(C(C(C(C(COP([O-])([O-])=O)O)O)O)O)O" cannot be used as a page name in this wiki.