Difference between revisions of "CPD-19170"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HISTIDINAL HISTIDINAL] == * smiles: ** C1(NC=NC=1CC([CH]=O)[N+]) * inchi key: ** InChIKey=VYOIE...")
 
 
(3 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HISTIDINAL HISTIDINAL] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19170 CPD-19170] ==
 
* smiles:
 
* smiles:
** C1(NC=NC=1CC([CH]=O)[N+])
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** CCCCCCCCC=CCCCC=CC(=O)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-]
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* molecular weight:
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** 997.883   
 
* inchi key:
 
* inchi key:
** InChIKey=VYOIELONWKIZJS-YFKPBYRVSA-O
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** InChIKey=YQARRKBGBKPBCX-DVZFGLDUSA-J
 
* common name:
 
* common name:
** histidinal
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** (2E,7Z)-hexadecenoyl-CoA
* molecular weight:
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** 140.164   
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* Synonym(s):
 
* Synonym(s):
** L-histidinal
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** 16:2-Δ2,Δ7-CoA
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** 2-trans,7-cis-hexadecenoyl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[HISTALDEHYD-RXN]]
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* [[RXN-17780]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-17779]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[HISTOLDEHYD-RXN]]
 
 
== External links  ==
 
== External links  ==
* PUBCHEM:
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{{#set: smiles=CCCCCCCCC=CCCCC=CC(=O)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-]}}
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=57339283 57339283]
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{{#set: molecular weight=997.883    }}
* CHEBI:
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{{#set: inchi key=InChIKey=YQARRKBGBKPBCX-DVZFGLDUSA-J}}
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=64802 64802]
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{{#set: common name=(2E,7Z)-hexadecenoyl-CoA}}
* LIGAND-CPD:
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{{#set: common name=16:2-Δ2,Δ7-CoA|2-trans,7-cis-hexadecenoyl-CoA}}
** [http://www.genome.jp/dbget-bin/www_bget?C01929 C01929]
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{{#set: consumed by=RXN-17780}}
* HMDB : HMDB12234
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{{#set: produced by=RXN-17779}}
{{#set: smiles=C1(NC=NC=1CC([CH]=O)[N+])}}
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{{#set: inchi key=InChIKey=VYOIELONWKIZJS-YFKPBYRVSA-O}}
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{{#set: common name=histidinal}}
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{{#set: molecular weight=140.164    }}
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{{#set: common name=L-histidinal}}
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{{#set: consumed by=HISTALDEHYD-RXN}}
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{{#set: consumed or produced by=HISTOLDEHYD-RXN}}
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Latest revision as of 15:48, 9 January 2019

Metabolite CPD-19170

  • smiles:
    • CCCCCCCCC=CCCCC=CC(=O)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-]
  • molecular weight:
    • 997.883
  • inchi key:
    • InChIKey=YQARRKBGBKPBCX-DVZFGLDUSA-J
  • common name:
    • (2E,7Z)-hexadecenoyl-CoA
  • Synonym(s):
    • 16:2-Δ2,Δ7-CoA
    • 2-trans,7-cis-hexadecenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCC=CCCCC=CC(=O)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-" cannot be used as a page name in this wiki.