Difference between revisions of "CPD66-23"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CA+2 CA+2] == * smiles: ** [Ca++] * common name: ** Ca2+ * inchi key: ** InChIKey=BHPQYMZQTOCNF...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD66-23 CPD66-23] == * smiles: ** CC(=O)C3(O)(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34)))...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CA+2 CA+2] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD66-23 CPD66-23] ==
 
* smiles:
 
* smiles:
** [Ca++]
+
** CC(=O)C3(O)(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))
 
* common name:
 
* common name:
** Ca2+
+
** 17-α-hydroxypregnenolone
 
* inchi key:
 
* inchi key:
** InChIKey=BHPQYMZQTOCNFJ-UHFFFAOYSA-N
+
** InChIKey=JERGUCIJOXJXHF-TVWVXWENSA-N
 
* molecular weight:
 
* molecular weight:
** 40.08    
+
** 332.482    
 
* Synonym(s):
 
* Synonym(s):
** Ca+2
 
** Ca++
 
** calcium ion
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[TransportSeed_CA+2]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[TransportSeed_CA+2]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[ExchangeSeed_CA+2]]
+
* [[RXN66-350]]
* [[3.6.3.8-RXN]]
+
 
== External links  ==
 
== External links  ==
* BIGG : ca2
+
* LIPID_MAPS : LMST02030089
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=271 271]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91451 91451]
* HMDB : HMDB00464
+
* HMDB : HMDB00363
* LIGAND-CPD:
+
** [http://www.genome.jp/dbget-bin/www_bget?C00076 C00076]
+
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.266.html 266]
+
** [http://www.chemspider.com/Chemical-Structure.217096.html 217096]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29108 29108]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28750 28750]
* METABOLIGHTS : MTBLC29108
+
* METABOLIGHTS : MTBLC28750
{{#set: smiles=[Ca++]}}
+
{{#set: smiles=CC(=O)C3(O)(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))}}
{{#set: common name=Ca2+}}
+
{{#set: common name=17-α-hydroxypregnenolone}}
{{#set: inchi key=InChIKey=BHPQYMZQTOCNFJ-UHFFFAOYSA-N}}
+
{{#set: inchi key=InChIKey=JERGUCIJOXJXHF-TVWVXWENSA-N}}
{{#set: molecular weight=40.08   }}
+
{{#set: molecular weight=332.482   }}
{{#set: common name=Ca+2|Ca++|calcium ion}}
+
{{#set: reversible reaction associated=RXN66-350}}
{{#set: consumed by=TransportSeed_CA+2}}
+
{{#set: produced by=TransportSeed_CA+2}}
+
{{#set: reversible reaction associated=ExchangeSeed_CA+2|3.6.3.8-RXN}}
+

Latest revision as of 20:22, 21 March 2018

Metabolite CPD66-23

  • smiles:
    • CC(=O)C3(O)(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))
  • common name:
    • 17-α-hydroxypregnenolone
  • inchi key:
    • InChIKey=JERGUCIJOXJXHF-TVWVXWENSA-N
  • molecular weight:
    • 332.482
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIPID_MAPS : LMST02030089
  • PUBCHEM:
  • HMDB : HMDB00363
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC28750
"CC(=O)C3(O)(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))" cannot be used as a page name in this wiki.