Difference between revisions of "CPD-17347"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-KETO-3-DEOXY-6-P-GLUCONATE 2-KETO-3-DEOXY-6-P-GLUCONATE] == * smiles: ** C(=O)([O-])C(=O)CC(O...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17347 CPD-17347] == * smiles: ** CCCCCC=CCC=CCCCCCCCC(O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)C...")
 
(2 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-KETO-3-DEOXY-6-P-GLUCONATE 2-KETO-3-DEOXY-6-P-GLUCONATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17347 CPD-17347] ==
 
* smiles:
 
* smiles:
−
** C(=O)([O-])C(=O)CC(O)C(O)COP([O-])(=O)[O-]
+
** CCCCCC=CCC=CCCCCCCCC(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=OVPRPPOVAXRCED-WVZVXSGGSA-K
+
 
* common name:
 
* common name:
−
** 2-dehydro-3-deoxy-D-gluconate 6-phosphate
+
** (3R)-hydroxy-(11Z,14Z)-icosa-11,14-dienoyl-CoA
 +
* inchi key:
 +
** InChIKey=MNTSLNSVZACNCX-JPDDAYGWSA-J
 
* molecular weight:
 
* molecular weight:
−
** 255.098    
+
** 1069.99    
 
* Synonym(s):
 
* Synonym(s):
−
** 2-keto-3-deoxy-6-phospho-D-gluconate
+
** (3R)-hydroxy-20:2Δ11,14
−
** 2-dehydro-3-deoxy-6-phospho-D-gluconate
+
−
** 2-keto-3-deoxy-6-phospho-gluconate
+
−
** 6-phospho-2-dehydro-3-deoxy-D-gluconate
+
−
** 2-keto-3-deoxy-6-phosphogluconate
+
−
** 2-keto-3-deoxy-6-P-gluconate
+
−
** 6-p-2-k-3-deo-gluconate
+
−
** 6-phospho-2-keto-3-deoxygluconate
+
−
** 6-phospho-2-dehydro-3-deoxygluconate
+
−
** 2-keto-3-deoxygluconate-6-P
+
−
** 3-deoxy-D-erythro-hex-2-ulosonic acid 6-phosphate
+
−
** 3-deoxy-D-erythro-hex-2-ulosonate-6-phosphate
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[KDPGALDOL-RXN]]
+
* [[RXN-16096]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-16095]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* CAS : 27244-54-8
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44229082 44229082]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=72193805 72193805]
−
* HMDB : HMDB01376
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C04442 C04442]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57569 57569]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=76408 76408]
−
* BIGG : 2ddg6p
+
{{#set: smiles=CCCCCC=CCC=CCCCCCCCC(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: smiles=C(=O)([O-])C(=O)CC(O)C(O)COP([O-])(=O)[O-]}}
+
{{#set: common name=(3R)-hydroxy-(11Z,14Z)-icosa-11,14-dienoyl-CoA}}
−
{{#set: inchi key=InChIKey=OVPRPPOVAXRCED-WVZVXSGGSA-K}}
+
{{#set: inchi key=InChIKey=MNTSLNSVZACNCX-JPDDAYGWSA-J}}
−
{{#set: common name=2-dehydro-3-deoxy-D-gluconate 6-phosphate}}
+
{{#set: molecular weight=1069.99   }}
−
{{#set: molecular weight=255.098   }}
+
{{#set: common name=(3R)-hydroxy-20:2Δ11,14}}
−
{{#set: common name=2-keto-3-deoxy-6-phospho-D-gluconate|2-dehydro-3-deoxy-6-phospho-D-gluconate|2-keto-3-deoxy-6-phospho-gluconate|6-phospho-2-dehydro-3-deoxy-D-gluconate|2-keto-3-deoxy-6-phosphogluconate|2-keto-3-deoxy-6-P-gluconate|6-p-2-k-3-deo-gluconate|6-phospho-2-keto-3-deoxygluconate|6-phospho-2-dehydro-3-deoxygluconate|2-keto-3-deoxygluconate-6-P|3-deoxy-D-erythro-hex-2-ulosonic acid 6-phosphate|3-deoxy-D-erythro-hex-2-ulosonate-6-phosphate}}
+
{{#set: consumed by=RXN-16096}}
−
{{#set: consumed by=KDPGALDOL-RXN}}
+
{{#set: produced by=RXN-16095}}

Latest revision as of 19:54, 21 March 2018

Metabolite CPD-17347

  • smiles:
    • CCCCCC=CCC=CCCCCCCCC(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-]
  • common name:
    • (3R)-hydroxy-(11Z,14Z)-icosa-11,14-dienoyl-CoA
  • inchi key:
    • InChIKey=MNTSLNSVZACNCX-JPDDAYGWSA-J
  • molecular weight:
    • 1069.99
  • Synonym(s):
    • (3R)-hydroxy-20:2Δ11,14

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCC=CCC=CCCCCCCCC(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.




Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=CPD-17347&oldid=44544"