Difference between revisions of "MYO-INOSITOL"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=LINOLENOYL-COA LINOLENOYL-COA] == * smiles: ** CCC=CCC=CCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MYO-INOSITOL MYO-INOSITOL] == * smiles: ** C1(C(C(C(C(C1O)O)O)O)O)O * inchi key: ** InChIKey=CD...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=LINOLENOYL-COA LINOLENOYL-COA] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MYO-INOSITOL MYO-INOSITOL] ==
 
* smiles:
 
* smiles:
−
** CCC=CCC=CCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC3(OC(N2(C=NC1(C(N)=NC=NC=12)))C(O)C(OP(=O)([O-])[O-])3)
+
** C1(C(C(C(C(C1O)O)O)O)O)O
 
* inchi key:
 
* inchi key:
−
** InChIKey=OMKFKBGZHNJNEX-KZWMEWPFSA-J
+
** InChIKey=CDAISMWEOUEBRE-GPIVLXJGSA-N
 
* common name:
 
* common name:
−
** α-linolenoyl-CoA
+
** myo-inositol
 
* molecular weight:
 
* molecular weight:
−
** 1023.921    
+
** 180.157    
 
* Synonym(s):
 
* Synonym(s):
−
** 18:3Δ9,12,15
+
** cis-1,2,3,5-trans-4,6-Cyclohexanehexol
−
** (9Z,12Z,15Z)-octadecatrienoyl-CoA
+
** dambose
 +
** mesoinositol
 +
** meso-inositol
 +
** M-inositol
 +
** 1,2,3,5/4,6 inositol
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-13426]]
+
* [[MYO-INOSITOL-OXYGENASE-RXN]]
 +
* [[2.7.8.11-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[LINOLENOYL-RXN]]
+
* [[RXN-10954]]
 +
* [[RXN-10953]]
 +
* [[RXN-7253]]
 +
* [[RXN-10952]]
 +
* [[RXN-8281]]
 +
* [[RXN-10949]]
 +
* [[MYO-INOSITOL-1OR-4-MONOPHOSPHATASE-RXN]]
 +
* [[RXN0-5408]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[MYO-INOSITOL-2-DEHYDROGENASE-RXN]]
 +
* [[2.4.1.67-RXN]]
 
== External links  ==
 
== External links  ==
 +
* CAS : 6917-35-7
 +
* CAS : 87-89-8
 +
* BIGG : 33990
 +
* DRUGBANK : DB03106
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=892 892]
 +
* KNAPSACK : C00001164
 +
* HMDB : HMDB00211
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C16162 C16162]
+
** [http://www.genome.jp/dbget-bin/www_bget?C00137 C00137]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.868.html 868]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=51985 51985]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17268 17268]
−
* METABOLIGHTS : MTBLC51985
+
* METABOLIGHTS : MTBLC17268
−
* PUBCHEM:
+
{{#set: smiles=C1(C(C(C(C(C1O)O)O)O)O)O}}
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=49859601 49859601]
+
{{#set: inchi key=InChIKey=CDAISMWEOUEBRE-GPIVLXJGSA-N}}
−
* HMDB : HMDB06290
+
{{#set: common name=myo-inositol}}
−
{{#set: smiles=CCC=CCC=CCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC3(OC(N2(C=NC1(C(N)=NC=NC=12)))C(O)C(OP(=O)([O-])[O-])3)}}
+
{{#set: molecular weight=180.157   }}
−
{{#set: inchi key=InChIKey=OMKFKBGZHNJNEX-KZWMEWPFSA-J}}
+
{{#set: common name=cis-1,2,3,5-trans-4,6-Cyclohexanehexol|dambose|mesoinositol|meso-inositol|M-inositol|1,2,3,5/4,6 inositol}}
−
{{#set: common name=α-linolenoyl-CoA}}
+
{{#set: consumed by=MYO-INOSITOL-OXYGENASE-RXN|2.7.8.11-RXN}}
−
{{#set: molecular weight=1023.921   }}
+
{{#set: produced by=RXN-10954|RXN-10953|RXN-7253|RXN-10952|RXN-8281|RXN-10949|MYO-INOSITOL-1OR-4-MONOPHOSPHATASE-RXN|RXN0-5408}}
−
{{#set: common name=18:3Δ9,12,15|(9Z,12Z,15Z)-octadecatrienoyl-CoA}}
+
{{#set: reversible reaction associated=MYO-INOSITOL-2-DEHYDROGENASE-RXN|2.4.1.67-RXN}}
−
{{#set: consumed by=RXN-13426}}
+
−
{{#set: produced by=LINOLENOYL-RXN}}
+

Latest revision as of 20:26, 21 March 2018

Metabolite MYO-INOSITOL

  • smiles:
    • C1(C(C(C(C(C1O)O)O)O)O)O
  • inchi key:
    • InChIKey=CDAISMWEOUEBRE-GPIVLXJGSA-N
  • common name:
    • myo-inositol
  • molecular weight:
    • 180.157
  • Synonym(s):
    • cis-1,2,3,5-trans-4,6-Cyclohexanehexol
    • dambose
    • mesoinositol
    • meso-inositol
    • M-inositol
    • 1,2,3,5/4,6 inositol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 6917-35-7
  • CAS : 87-89-8
  • BIGG : 33990
  • DRUGBANK : DB03106
  • PUBCHEM:
  • KNAPSACK : C00001164
  • HMDB : HMDB00211
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC17268





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