Difference between revisions of "Tiso gene 13981"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-C-METHYL-D-ERYTHRITOL-4-PHOSPHATE 2-C-METHYL-D-ERYTHRITOL-4-PHOSPHATE] == * smiles: ** CC(O)(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18346 CPD-18346] == * smiles: ** CCCCCCC=CCCCCCCCCCC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-C-METHYL-D-ERYTHRITOL-4-PHOSPHATE 2-C-METHYL-D-ERYTHRITOL-4-PHOSPHATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18346 CPD-18346] ==
 
* smiles:
 
* smiles:
−
** CC(O)(CO)C(O)COP([O-])([O-])=O
+
** CCCCCCC=CCCCCCCCCCC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
 
* inchi key:
 
* inchi key:
−
** InChIKey=XMWHRVNVKDKBRG-UHNVWZDZSA-L
+
** InChIKey=HEJOXXLSCAQQGQ-SAIINBSPSA-J
 
* common name:
 
* common name:
−
** 2-C-methyl-D-erythritol 4-phosphate
+
** cis-vaccenoyl-CoA
 
* molecular weight:
 
* molecular weight:
−
** 214.111    
+
** 1027.953    
 
* Synonym(s):
 
* Synonym(s):
−
** MEP
+
** (Z)-octadec-11-enoyl CoA
−
** 2-methylerylthritol 4-phosphate
+
** (Z)-11-octadecenoic acyl-CoA
 +
** cis-11-octadecenoic acyl-CoA
 +
** cis-octadec-11-enoic acyl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[2.7.7.60-RXN]]
+
* [[RXN-17011]]
 +
* [[RXN-17010]]
 +
* [[RXN-17784]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN0-7238]]
 +
* [[FACOAL18111Z]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[DXPREDISOM-RXN]]
 
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=21608483 21608483]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=71668355 71668355]
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.10645747.html 10645747]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58262 58262]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=75121 75121]
−
* BIGG : 2me4p
+
{{#set: smiles=CCCCCCC=CCCCCCCCCCC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O}}
−
* LIGAND-CPD:
+
{{#set: inchi key=InChIKey=HEJOXXLSCAQQGQ-SAIINBSPSA-J}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C11434 C11434]
+
{{#set: common name=cis-vaccenoyl-CoA}}
−
{{#set: smiles=CC(O)(CO)C(O)COP([O-])([O-])=O}}
+
{{#set: molecular weight=1027.953   }}
−
{{#set: inchi key=InChIKey=XMWHRVNVKDKBRG-UHNVWZDZSA-L}}
+
{{#set: common name=(Z)-octadec-11-enoyl CoA|(Z)-11-octadecenoic acyl-CoA|cis-11-octadecenoic acyl-CoA|cis-octadec-11-enoic acyl-CoA}}
−
{{#set: common name=2-C-methyl-D-erythritol 4-phosphate}}
+
{{#set: consumed by=RXN-17011|RXN-17010|RXN-17784}}
−
{{#set: molecular weight=214.111   }}
+
{{#set: produced by=RXN0-7238|FACOAL18111Z}}
−
{{#set: common name=MEP|2-methylerylthritol 4-phosphate}}
+
−
{{#set: consumed by=2.7.7.60-RXN}}
+
−
{{#set: consumed or produced by=DXPREDISOM-RXN}}
+

Revision as of 18:36, 18 March 2018

Metabolite CPD-18346

  • smiles:
    • CCCCCCC=CCCCCCCCCCC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
  • inchi key:
    • InChIKey=HEJOXXLSCAQQGQ-SAIINBSPSA-J
  • common name:
    • cis-vaccenoyl-CoA
  • molecular weight:
    • 1027.953
  • Synonym(s):
    • (Z)-octadec-11-enoyl CoA
    • (Z)-11-octadecenoic acyl-CoA
    • cis-11-octadecenoic acyl-CoA
    • cis-octadec-11-enoic acyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCC=CCCCCCCCCCC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O" cannot be used as a page name in this wiki.




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