Difference between revisions of "CPD-237"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15668 CPD-15668] == * smiles: ** CCCCCCC=CCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-237 CPD-237] == * smiles: ** C1(=C(CC(N)=O)C2(=CC=CC=C(N1)2)) * common name: ** indole-3-ac...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15668 CPD-15668] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-237 CPD-237] ==
 
* smiles:
 
* smiles:
** CCCCCCC=CCCC(=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-]
+
** C1(=C(CC(N)=O)C2(=CC=CC=C(N1)2))
 
* common name:
 
* common name:
** 4-cis-undecenoyl-CoA
+
** indole-3-acetamide
 
* inchi key:
 
* inchi key:
** InChIKey=AFMMIIQKXQNEDN-NSDZGHCESA-J
+
** InChIKey=ZOAMBXDOGPRZLP-UHFFFAOYSA-N
 
* molecular weight:
 
* molecular weight:
** 929.765    
+
** 174.202    
 
* Synonym(s):
 
* Synonym(s):
** 4Z-undecenoyl-CoA
+
** 1H-indole-3-acetamide
 +
** indoleacetamide
 +
** (indol-3-yl)acetamide
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-14775]]
+
* [[RXNN-404]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14774]]
+
* [[RXN-7567]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 879-37-8
 +
* DRUGBANK : DB08652
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658173 90658173]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=397 397]
{{#set: smiles=CCCCCCC=CCCC(=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-]}}
+
* HMDB : HMDB29739
{{#set: common name=4-cis-undecenoyl-CoA}}
+
* LIGAND-CPD:
{{#set: inchi key=InChIKey=AFMMIIQKXQNEDN-NSDZGHCESA-J}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C02693 C02693]
{{#set: molecular weight=929.765   }}
+
* CHEMSPIDER:
{{#set: common name=4Z-undecenoyl-CoA}}
+
** [http://www.chemspider.com/Chemical-Structure.386.html 386]
{{#set: consumed by=RXN-14775}}
+
* CHEBI:
{{#set: produced by=RXN-14774}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16031 16031]
 +
* METABOLIGHTS : MTBLC16031
 +
{{#set: smiles=C1(=C(CC(N)=O)C2(=CC=CC=C(N1)2))}}
 +
{{#set: common name=indole-3-acetamide}}
 +
{{#set: inchi key=InChIKey=ZOAMBXDOGPRZLP-UHFFFAOYSA-N}}
 +
{{#set: molecular weight=174.202   }}
 +
{{#set: common name=1H-indole-3-acetamide|indoleacetamide|(indol-3-yl)acetamide}}
 +
{{#set: consumed by=RXNN-404}}
 +
{{#set: produced by=RXN-7567}}

Latest revision as of 19:51, 21 March 2018

Metabolite CPD-237

  • smiles:
    • C1(=C(CC(N)=O)C2(=CC=CC=C(N1)2))
  • common name:
    • indole-3-acetamide
  • inchi key:
    • InChIKey=ZOAMBXDOGPRZLP-UHFFFAOYSA-N
  • molecular weight:
    • 174.202
  • Synonym(s):
    • 1H-indole-3-acetamide
    • indoleacetamide
    • (indol-3-yl)acetamide

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 879-37-8
  • DRUGBANK : DB08652
  • PUBCHEM:
  • HMDB : HMDB29739
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16031