Difference between revisions of "CPD-17385"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=VAL VAL] == * smiles: ** CC(C)C([N+])C([O-])=O * inchi key: ** InChIKey=KZSNJWFQEVHDMF-BYPYZUCN...")
 
 
(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=VAL VAL] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17385 CPD-17385] ==
 
* smiles:
 
* smiles:
** CC(C)C([N+])C([O-])=O
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** CCC=CCC=CCC=CCC=CCC=CCC=CCCCCC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O
 +
* molecular weight:
 +
** 1102.034   
 
* inchi key:
 
* inchi key:
** InChIKey=KZSNJWFQEVHDMF-BYPYZUCNSA-N
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** InChIKey=KRIFZIRXAAITHR-KWFBMMABSA-J
 
* common name:
 
* common name:
** L-valine
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** (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoyl-CoA
* molecular weight:
+
** 117.147   
+
 
* Synonym(s):
 
* Synonym(s):
** V
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** tetracosahexaenoyl-CoA
** val
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** all-cis6,-9,12,15,18,21-tetracosahexaenoyl-CoA
** valine
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** (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoyl-CoA
** L-val
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[VALINE--TRNA-LIGASE-RXN]]
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* [[RXN-16134]]
* [[BIOMASS-RXN]]
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== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-16132]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[BRANCHED-CHAINAMINOTRANSFERVAL-RXN]]
 
 
== External links  ==
 
== External links  ==
* CAS : 72-18-4
 
* METABOLIGHTS : MTBLC57762
 
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6971018 6971018]
 
* HMDB : HMDB00883
 
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C00183 C00183]
 
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57762 57762]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=74086 74086]
* BIGG : val__L
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* PUBCHEM:
{{#set: smiles=CC(C)C([N+])C([O-])=O}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=71581194 71581194]
{{#set: inchi key=InChIKey=KZSNJWFQEVHDMF-BYPYZUCNSA-N}}
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{{#set: smiles=CCC=CCC=CCC=CCC=CCC=CCC=CCCCCC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O}}
{{#set: common name=L-valine}}
+
{{#set: molecular weight=1102.034    }}
{{#set: molecular weight=117.147    }}
+
{{#set: inchi key=InChIKey=KRIFZIRXAAITHR-KWFBMMABSA-J}}
{{#set: common name=V|val|valine|L-val}}
+
{{#set: common name=(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoyl-CoA}}
{{#set: consumed by=VALINE--TRNA-LIGASE-RXN|BIOMASS-RXN}}
+
{{#set: common name=tetracosahexaenoyl-CoA|all-cis6,-9,12,15,18,21-tetracosahexaenoyl-CoA|(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoyl-CoA}}
{{#set: consumed or produced by=BRANCHED-CHAINAMINOTRANSFERVAL-RXN}}
+
{{#set: consumed by=RXN-16134}}
 +
{{#set: produced by=RXN-16132}}

Latest revision as of 17:10, 9 January 2019

Metabolite CPD-17385

  • smiles:
    • CCC=CCC=CCC=CCC=CCC=CCC=CCCCCC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O
  • molecular weight:
    • 1102.034
  • inchi key:
    • InChIKey=KRIFZIRXAAITHR-KWFBMMABSA-J
  • common name:
    • (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoyl-CoA
  • Synonym(s):
    • tetracosahexaenoyl-CoA
    • all-cis6,-9,12,15,18,21-tetracosahexaenoyl-CoA
    • (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCC=CCC=CCC=CCC=CCC=CCC=CCCCCC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-])=O" cannot be used as a page name in this wiki.