Difference between revisions of "Ec-06 007890"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MALONYL-COA MALONYL-COA] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)[O-])COP(=O)(OP(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2106 CPD0-2106] == * smiles: ** CCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MALONYL-COA MALONYL-COA] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2106 CPD0-2106] ==
 
* smiles:
 
* smiles:
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)[O-])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-]
+
** CCCCCC(=O)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-]
 
* inchi key:
 
* inchi key:
** InChIKey=LTYOQGRJFJAKNA-DVVLENMVSA-I
+
** InChIKey=WPIVBCGRGVNDDT-CECATXLMSA-J
 
* common name:
 
* common name:
** malonyl-CoA
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** 3-oxooctanoyl-CoA
 
* molecular weight:
 
* molecular weight:
** 848.541    
+
** 903.684    
 
* Synonym(s):
 
* Synonym(s):
** malonyl coenzyme A
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-16081]]
 
* [[RXN-16082]]
 
* [[NARINGENIN-CHALCONE-SYNTHASE-RXN]]
 
* [[RXN1G-445]]
 
* [[RXN-7645]]
 
* [[RXN-9654]]
 
* [[RXN1G-368]]
 
* [[RXN-10734]]
 
* [[RXN-9632]]
 
* [[RXN-9653]]
 
* [[RXN-9652]]
 
* [[RXN-9651]]
 
* [[RXN-9650]]
 
* [[RXN-13442]]
 
* [[RXN-16079]]
 
* [[RXN-16094]]
 
* [[RXN-10059]]
 
* [[RXN-13295]]
 
* [[RXN-16016]]
 
* [[RXN-3142]]
 
* [[RXN1G-499]]
 
* [[RXN-9648]]
 
* [[MALONYL-COA-DECARBOXYLASE-RXN]]
 
* [[RXN-13322]]
 
* [[RXN-13431]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN0-5055]]
 
* [[ACETYL-COA-CARBOXYLTRANSFER-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[FATTY-ACYL-COA-SYNTHASE-RXN]]
+
* [[RXN-14277]]
* [[FATTY-ACID-SYNTHASE-RXN]]
+
* [[MALONYL-COA-ACP-TRANSACYL-RXN]]
+
 
== External links  ==
 
== External links  ==
* CAS : 524-14-1
 
* BIGG : 33789
 
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266608 45266608]
 
* HMDB : HMDB01175
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C00083 C00083]
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** [http://www.genome.jp/dbget-bin/www_bget?C05267 C05267]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57384 57384]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62619 62619]
* METABOLIGHTS : MTBLC57384
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* BIGG : 45463
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)[O-])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-]}}
+
* PUBCHEM:
{{#set: inchi key=InChIKey=LTYOQGRJFJAKNA-DVVLENMVSA-I}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46173417 46173417]
{{#set: common name=malonyl-CoA}}
+
* HMDB : HMDB03941
{{#set: molecular weight=848.541   }}
+
{{#set: smiles=CCCCCC(=O)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-]}}
{{#set: common name=malonyl coenzyme A}}
+
{{#set: inchi key=InChIKey=WPIVBCGRGVNDDT-CECATXLMSA-J}}
{{#set: consumed by=RXN-16081|RXN-16082|NARINGENIN-CHALCONE-SYNTHASE-RXN|RXN1G-445|RXN-7645|RXN-9654|RXN1G-368|RXN-10734|RXN-9632|RXN-9653|RXN-9652|RXN-9651|RXN-9650|RXN-13442|RXN-16079|RXN-16094|RXN-10059|RXN-13295|RXN-16016|RXN-3142|RXN1G-499|RXN-9648|MALONYL-COA-DECARBOXYLASE-RXN|RXN-13322|RXN-13431}}
+
{{#set: common name=3-oxooctanoyl-CoA}}
{{#set: produced by=RXN0-5055|ACETYL-COA-CARBOXYLTRANSFER-RXN}}
+
{{#set: molecular weight=903.684   }}
{{#set: reversible reaction associated=FATTY-ACYL-COA-SYNTHASE-RXN|FATTY-ACID-SYNTHASE-RXN|MALONYL-COA-ACP-TRANSACYL-RXN}}
+
{{#set: reversible reaction associated=RXN-14277}}

Revision as of 13:42, 21 March 2018

Metabolite CPD0-2106

  • smiles:
    • CCCCCC(=O)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-]
  • inchi key:
    • InChIKey=WPIVBCGRGVNDDT-CECATXLMSA-J
  • common name:
    • 3-oxooctanoyl-CoA
  • molecular weight:
    • 903.684
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCC(=O)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.