Difference between revisions of "TransportSeed OXYGEN-MOLECULE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=S2O3 S2O3] == * smiles: ** O=S(=O)([O-])S * inchi key: ** InChIKey=DHCDFWKWKRSZHF-UHFFFAOYSA-M...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12904 CPD-12904] == * smiles: ** CC(C)=CC=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=S2O3 S2O3] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12904 CPD-12904] ==
 
* smiles:
 
* smiles:
−
** O=S(=O)([O-])S
+
** CC(C)=CC=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=DHCDFWKWKRSZHF-UHFFFAOYSA-M
+
 
* common name:
 
* common name:
−
** thiosulfate
+
** (2E)-5-methylhexa-2,4-dienoyl-CoA
 +
* inchi key:
 +
** InChIKey=IFMYVRQEHQTINS-MEOYLLPMSA-J
 
* molecular weight:
 
* molecular weight:
−
** 113.126    
+
** 871.642    
 
* Synonym(s):
 
* Synonym(s):
−
** S2O3
 
−
** S2O32-
 
−
** S2O3-2
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[THIOSULFATE-SULFURTRANSFERASE-RXN]]
+
* [[RXN-11919]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[RXN0-6385]]
 
−
* [[SULFOCYS-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* METABOLIGHTS : MTBLC33539
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=439208 439208]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=50986176 50986176]
−
* HMDB : HMDB00257
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C00320 C00320]
+
** [http://www.genome.jp/dbget-bin/www_bget?C16468 C16468]
−
* CHEMSPIDER:
+
{{#set: smiles=CC(C)=CC=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://www.chemspider.com/Chemical-Structure.388348.html 388348]
+
{{#set: common name=(2E)-5-methylhexa-2,4-dienoyl-CoA}}
−
* CHEBI:
+
{{#set: inchi key=InChIKey=IFMYVRQEHQTINS-MEOYLLPMSA-J}}
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=33539 33539]
+
{{#set: molecular weight=871.642    }}
−
* BIGG : tsul
+
{{#set: consumed by=RXN-11919}}
−
{{#set: smiles=O=S(=O)([O-])S}}
+
−
{{#set: inchi key=InChIKey=DHCDFWKWKRSZHF-UHFFFAOYSA-M}}
+
−
{{#set: common name=thiosulfate}}
+
−
{{#set: molecular weight=113.126    }}
+
−
{{#set: common name=S2O3|S2O32-|S2O3-2}}
+
−
{{#set: consumed by=THIOSULFATE-SULFURTRANSFERASE-RXN}}
+
−
{{#set: reversible reaction associated=RXN0-6385|SULFOCYS-RXN}}
+

Revision as of 16:13, 21 March 2018

Metabolite CPD-12904

  • smiles:
    • CC(C)=CC=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:
    • (2E)-5-methylhexa-2,4-dienoyl-CoA
  • inchi key:
    • InChIKey=IFMYVRQEHQTINS-MEOYLLPMSA-J
  • molecular weight:
    • 871.642
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)=CC=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.



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