Difference between revisions of "CPD-17372"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=COB-I-ALAMIN COB-I-ALAMIN] == * smiles: ** CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC...")
 
 
(One intermediate revision by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=COB-I-ALAMIN COB-I-ALAMIN] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17372 CPD-17372] ==
 
* smiles:
 
* smiles:
−
** CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC(=O)CCC1(C)(C(CC(N)=O)[CH]%11(C7(C)(C(C)(CC(N)=O)C(CCC(=O)N)C6(C(C)=C5(C(CC(=O)N)(C)C(CCC(N)=O)C4(C=C3(C(C)(C)C(CCC(N)=O)C2(C(C)=C1N([Co----]([N+]=23)([N+]=45)([N+]=67)[N+](=C8)C9=C%10)%11)))))))))C(O)%12))))
+
** C(O)CCCCCCCC=CCCCCCCCC(=O)OCC(COP([O-])([O-])=O)O
 +
* molecular weight:
 +
** 450.508   
 
* inchi key:
 
* inchi key:
−
** InChIKey=OMAOKVYASDIYQG-DSRCUDDDSA-L
+
** InChIKey=GFJKJLHWWZXDAU-KXFGNQBASA-L
 
* common name:
 
* common name:
−
** cob(I)alamin
+
** 1-[18-hydroxyoleyl]-2-lyso-phosphatidate
−
* molecular weight:
+
−
** 1329.36   
+
 
* Synonym(s):
 
* Synonym(s):
−
** cobalamin
 
−
** B12s
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[TransportSeed_COB-I-ALAMIN]]
+
* [[RXN-16118]]
−
* [[COBALADENOSYLTRANS-RXN]]
+
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[TransportSeed_COB-I-ALAMIN]]
+
* [[RXN-16117]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[ExchangeSeed_COB-I-ALAMIN]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 18534-66-2
 
−
* METABOLIGHTS : MTBLC15982
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460183 5460183]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91820233 91820233]
−
* HMDB : HMDB03429
+
{{#set: smiles=C(O)CCCCCCCC=CCCCCCCCC(=O)OCC(COP([O-])([O-])=O)O}}
−
* LIGAND-CPD:
+
{{#set: molecular weight=450.508   }}
−
** [http://www.genome.jp/dbget-bin/www_bget?C00853 C00853]
+
{{#set: inchi key=InChIKey=GFJKJLHWWZXDAU-KXFGNQBASA-L}}
−
* CHEMSPIDER:
+
{{#set: common name=1-[18-hydroxyoleyl]-2-lyso-phosphatidate}}
−
** [http://www.chemspider.com/Chemical-Structure.4573816.html 4573816]
+
{{#set: consumed by=RXN-16118}}
−
* CHEBI:
+
{{#set: produced by=RXN-16117}}
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15982 15982]
+
−
* BIGG : cbl1
+
−
{{#set: smiles=CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC(=O)CCC1(C)(C(CC(N)=O)[CH]%11(C7(C)(C(C)(CC(N)=O)C(CCC(=O)N)C6(C(C)=C5(C(CC(=O)N)(C)C(CCC(N)=O)C4(C=C3(C(C)(C)C(CCC(N)=O)C2(C(C)=C1N([Co----]([N+]=23)([N+]=45)([N+]=67)[N+](=C8)C9=C%10)%11)))))))))C(O)%12))))}}
+
−
{{#set: inchi key=InChIKey=OMAOKVYASDIYQG-DSRCUDDDSA-L}}
+
−
{{#set: common name=cob(I)alamin}}
+
−
{{#set: molecular weight=1329.36   }}
+
−
{{#set: common name=cobalamin|B12s}}
+
−
{{#set: consumed by=TransportSeed_COB-I-ALAMIN|COBALADENOSYLTRANS-RXN}}
+
−
{{#set: produced by=TransportSeed_COB-I-ALAMIN}}
+
−
{{#set: consumed or produced by=ExchangeSeed_COB-I-ALAMIN}}
+

Latest revision as of 17:11, 9 January 2019

Metabolite CPD-17372

  • smiles:
    • C(O)CCCCCCCC=CCCCCCCCC(=O)OCC(COP([O-])([O-])=O)O
  • molecular weight:
    • 450.508
  • inchi key:
    • InChIKey=GFJKJLHWWZXDAU-KXFGNQBASA-L
  • common name:
    • 1-[18-hydroxyoleyl]-2-lyso-phosphatidate
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C(O)CCCCCCCC=CCCCCCCCC(=O)OCC(COP([O-])([O-])=O)O" cannot be used as a page name in this wiki.


"1-[18-hydroxyoleyl]-2-lyso-phosphatidate" cannot be used as a page name in this wiki.


Retrieved from "http://gem-aureme.irisa.fr/ccrgem/index.php?title=CPD-17372&oldid=22789"