Difference between revisions of "CHC T00009477001"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2232 CPD0-2232] == * smiles: ** CCCCCCCCCCCCCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=4-P-PANTOTHENATE 4-P-PANTOTHENATE] == * smiles: ** CC(C(C(=O)NCCC(=O)[O-])O)(COP([O-])([O-])=O)...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2232 CPD0-2232] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=4-P-PANTOTHENATE 4-P-PANTOTHENATE] ==
 
* smiles:
 
* smiles:
−
** CCCCCCCCCCCCCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C(C1OP([O-])([O-])=O)O)N3(C=NC2(C(=NC=NC=23)N))))([O-])=O)(C)C)O)=O)=O)=O)O
+
** CC(C(C(=O)NCCC(=O)[O-])O)(COP([O-])([O-])=O)C
 
* inchi key:
 
* inchi key:
−
** InChIKey=DEHLMTDDPWDRDR-QQOJFMBSSA-J
+
** InChIKey=XHFVGHPGDLDEQO-ZETCQYMHSA-K
 
* common name:
 
* common name:
−
** (S)-3-hydroxyhexadecanoyl-CoA
+
** (R)-4'-phosphopantothenate
 
* molecular weight:
 
* molecular weight:
−
** 1017.914    
+
** 296.193    
 
* Synonym(s):
 
* Synonym(s):
−
** 3S-hydroxyhexadecanoyl-AoA
+
** 4'-phosphopantothenate
−
** (S)-3-hydroxypalmitoyl-CoA
+
** 4'-P-Pantothenate
 +
** D-4'-phosphopantothenate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-14271]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-14272]]
+
* [[PANTOTHENATE-KIN-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* BIGG : 4ppan
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=16755653 16755653]
 +
* HMDB : HMDB01016
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C05258 C05258]
+
** [http://www.genome.jp/dbget-bin/www_bget?C03492 C03492]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62613 62613]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=10986 10986]
−
* BIGG : 3hhdcoa
+
* METABOLIGHTS : MTBLC10986
−
* PUBCHEM:
+
{{#set: smiles=CC(C(C(=O)NCCC(=O)[O-])O)(COP([O-])([O-])=O)C}}
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=49859614 49859614]
+
{{#set: inchi key=InChIKey=XHFVGHPGDLDEQO-ZETCQYMHSA-K}}
−
* HMDB : HMDB03932
+
{{#set: common name=(R)-4'-phosphopantothenate}}
−
{{#set: smiles=CCCCCCCCCCCCCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C(C1OP([O-])([O-])=O)O)N3(C=NC2(C(=NC=NC=23)N))))([O-])=O)(C)C)O)=O)=O)=O)O}}
+
{{#set: molecular weight=296.193   }}
−
{{#set: inchi key=InChIKey=DEHLMTDDPWDRDR-QQOJFMBSSA-J}}
+
{{#set: common name=4'-phosphopantothenate|4'-P-Pantothenate|D-4'-phosphopantothenate}}
−
{{#set: common name=(S)-3-hydroxyhexadecanoyl-CoA}}
+
{{#set: produced by=PANTOTHENATE-KIN-RXN}}
−
{{#set: molecular weight=1017.914   }}
+
−
{{#set: common name=3S-hydroxyhexadecanoyl-AoA|(S)-3-hydroxypalmitoyl-CoA}}
+
−
{{#set: consumed by=RXN-14271}}
+
−
{{#set: produced by=RXN-14272}}
+

Revision as of 11:20, 18 January 2018

Metabolite 4-P-PANTOTHENATE

  • smiles:
    • CC(C(C(=O)NCCC(=O)[O-])O)(COP([O-])([O-])=O)C
  • inchi key:
    • InChIKey=XHFVGHPGDLDEQO-ZETCQYMHSA-K
  • common name:
    • (R)-4'-phosphopantothenate
  • molecular weight:
    • 296.193
  • Synonym(s):
    • 4'-phosphopantothenate
    • 4'-P-Pantothenate
    • D-4'-phosphopantothenate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • BIGG : 4ppan
  • PUBCHEM:
  • HMDB : HMDB01016
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC10986
"CC(C(C(=O)NCCC(=O)[O-])O)(COP([O-])([O-])=O)C" cannot be used as a page name in this wiki.



Retrieved from "http://gem-aureme.irisa.fr/ccrgem/index.php?title=CHC_T00009477001&oldid=7571"