Difference between revisions of "ALCDH nadp i"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6972 CPD-6972] == * smiles: ** CC(COP([O-])(=O)OP([O-])(=O)OCC3(C(C(C(N2(C=NC1(C(=NC=NC=12)...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BIOTIN BIOTIN] == * smiles: ** C1(SC(CCCCC(=O)[O-])[CH]2(NC(=O)N[CH]12)) * inchi key: ** InChIK...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6972 CPD-6972] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BIOTIN BIOTIN] ==
 
* smiles:
 
* smiles:
−
** CC(COP([O-])(=O)OP([O-])(=O)OCC3(C(C(C(N2(C=NC1(C(=NC=NC=12)N)))O3)O)OP([O-])(=O)[O-]))(C)C(C(NCCC(NCCSC(CCC(C4(C=CC=CC(C([O-])=O)=4))=O)=O)=O)=O)O
+
** C1(SC(CCCCC(=O)[O-])[CH]2(NC(=O)N[CH]12))
 
* inchi key:
 
* inchi key:
−
** InChIKey=KVAQAPQXOXTRAE-UHFFFAOYSA-I
+
** InChIKey=YBJHBAHKTGYVGT-ZKWXMUAHSA-M
 
* common name:
 
* common name:
−
** 4-(2'-carboxyphenyl)-4-oxobutyryl-CoA
+
** biotin
 
* molecular weight:
 
* molecular weight:
−
** 966.676    
+
** 243.3    
 
* Synonym(s):
 
* Synonym(s):
−
** succinylbenzoyl-CoA
+
** vitamin H
−
** 2-succinylbenzoyl-CoA
+
** coenzyme R
−
** 2-(3'-carboxypropionyl)benzoyl-CoA
+
** d-biotin
−
** o-succinylbenzoyl-CoA
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[NAPHTHOATE-SYN-RXN]]
+
* [[6.3.4.11-RXN]]
 +
* [[RXN0-7192]]
 +
* [[6.3.4.10-RXN]]
 +
* [[6.3.4.9-RXN]]
 +
* [[BIOTINLIG-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[2.8.1.6-RXN]]
 +
* [[RXN-17473]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 58-85-5
 +
* METABOLIGHTS : MTBLC57586
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245100 25245100]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6560210 6560210]
−
* CHEBI:
+
* HMDB : HMDB00030
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15509 15509]
+
−
* BIGG : sbzcoa
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C03160 C03160]
+
** [http://www.genome.jp/dbget-bin/www_bget?C00120 C00120]
−
{{#set: smiles=CC(COP([O-])(=O)OP([O-])(=O)OCC3(C(C(C(N2(C=NC1(C(=NC=NC=12)N)))O3)O)OP([O-])(=O)[O-]))(C)C(C(NCCC(NCCSC(CCC(C4(C=CC=CC(C([O-])=O)=4))=O)=O)=O)=O)O}}
+
* CHEMSPIDER:
−
{{#set: inchi key=InChIKey=KVAQAPQXOXTRAE-UHFFFAOYSA-I}}
+
** [http://www.chemspider.com/Chemical-Structure.5028036.html 5028036]
−
{{#set: common name=4-(2'-carboxyphenyl)-4-oxobutyryl-CoA}}
+
* CHEBI:
−
{{#set: molecular weight=966.676   }}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57586 57586]
−
{{#set: common name=succinylbenzoyl-CoA|2-succinylbenzoyl-CoA|2-(3'-carboxypropionyl)benzoyl-CoA|o-succinylbenzoyl-CoA}}
+
* BIGG : btn
−
{{#set: consumed by=NAPHTHOATE-SYN-RXN}}
+
{{#set: smiles=C1(SC(CCCCC(=O)[O-])[CH]2(NC(=O)N[CH]12))}}
 +
{{#set: inchi key=InChIKey=YBJHBAHKTGYVGT-ZKWXMUAHSA-M}}
 +
{{#set: common name=biotin}}
 +
{{#set: molecular weight=243.3   }}
 +
{{#set: common name=vitamin H|coenzyme R|d-biotin}}
 +
{{#set: consumed by=6.3.4.11-RXN|RXN0-7192|6.3.4.10-RXN|6.3.4.9-RXN|BIOTINLIG-RXN}}
 +
{{#set: produced by=2.8.1.6-RXN|RXN-17473}}

Revision as of 18:53, 18 March 2018

Metabolite BIOTIN

  • smiles:
    • C1(SC(CCCCC(=O)[O-])[CH]2(NC(=O)N[CH]12))
  • inchi key:
    • InChIKey=YBJHBAHKTGYVGT-ZKWXMUAHSA-M
  • common name:
    • biotin
  • molecular weight:
    • 243.3
  • Synonym(s):
    • vitamin H
    • coenzyme R
    • d-biotin

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 58-85-5
  • METABOLIGHTS : MTBLC57586
  • PUBCHEM:
  • HMDB : HMDB00030
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • BIGG : btn
"C1(SC(CCCCC(=O)[O-])[CH]2(NC(=O)N[CH]12))" cannot be used as a page name in this wiki.




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