Difference between revisions of "CPD-4577"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ASCORBATE ASCORBATE] == * smiles: ** C(O)C(O)[CH]1(C([O-])=C(O)C(=O)O1) * inchi key: ** InChIKe...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4577 CPD-4577] == * smiles: ** CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C([O-])=O)(C)C(O)CCC...")
 
(4 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ASCORBATE ASCORBATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4577 CPD-4577] ==
 
* smiles:
 
* smiles:
** C(O)C(O)[CH]1(C([O-])=C(O)C(=O)O1)
+
** CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C([O-])=O)(C)C(O)CCC(C)1C=2CCC(C)34))))
* inchi key:
+
** InChIKey=CIWBSHSKHKDKBQ-JLAZNSOCSA-M
+
 
* common name:
 
* common name:
** L-ascorbate
+
** 4α-carboxy-4β-methyl-5α-cholesta-8,24-dien-3β-ol
 +
* inchi key:
 +
** InChIKey=MYWAIWDQTCHPTH-LJAIZBFVSA-M
 
* molecular weight:
 
* molecular weight:
** 175.118    
+
** 441.673    
 
* Synonym(s):
 
* Synonym(s):
** L-ascorbic acid
+
** 4β-methyl-4α-carboxy-cholesta-8,24-dien-3β-ol
** ascorbate
+
** 4β-methylzymosterol-4α-carboxylate
** vitamin C
+
** ascorbic acid
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-12440]]
+
* [[RXN66-313]]
* [[RXN-3521]]
+
* [[RXN-10981]]
+
* [[RXN-7984]]
+
* [[RXN-7985]]
+
* [[PEPTIDYLGLYCINE-MONOOXYGENASE-RXN]]
+
* [[RXN-12876]]
+
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-3523]]
 
* [[1.6.5.4-RXN]]
 
* [[RXN-12440]]
 
* [[GALACTONOLACTONE-DEHYDROGENASE-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[RXN-13185]]
 
 
== External links  ==
 
== External links  ==
* CAS : 50-81-7
 
* METABOLIGHTS : MTBLC38290
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54679076 54679076]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=57339293 57339293]
* KNAPSACK : C00001179
+
* HMDB : HMDB06927
* HMDB : HMDB00044
+
* LIGAND-CPD:
+
** [http://www.genome.jp/dbget-bin/www_bget?C00072 C00072]
+
* CHEMSPIDER:
+
** [http://www.chemspider.com/Chemical-Structure.102746.html 102746]
+
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=38290 38290]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=64925 64925]
* BIGG : ascb__L
+
* LIGAND-CPD:
{{#set: smiles=C(O)C(O)[CH]1(C([O-])=C(O)C(=O)O1)}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C15808 C15808]
{{#set: inchi key=InChIKey=CIWBSHSKHKDKBQ-JLAZNSOCSA-M}}
+
{{#set: smiles=CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C([O-])=O)(C)C(O)CCC(C)1C=2CCC(C)34))))}}
{{#set: common name=L-ascorbate}}
+
{{#set: common name=4α-carboxy-4β-methyl-5α-cholesta-8,24-dien-3β-ol}}
{{#set: molecular weight=175.118   }}
+
{{#set: inchi key=InChIKey=MYWAIWDQTCHPTH-LJAIZBFVSA-M}}
{{#set: common name=L-ascorbic acid|ascorbate|vitamin C|ascorbic acid}}
+
{{#set: molecular weight=441.673   }}
{{#set: consumed by=RXN-12440|RXN-3521|RXN-10981|RXN-7984|RXN-7985|PEPTIDYLGLYCINE-MONOOXYGENASE-RXN|RXN-12876}}
+
{{#set: common name=4β-methyl-4α-carboxy-cholesta-8,24-dien-3β-ol|4β-methylzymosterol-4α-carboxylate}}
{{#set: produced by=RXN-3523|1.6.5.4-RXN|RXN-12440|GALACTONOLACTONE-DEHYDROGENASE-RXN}}
+
{{#set: consumed by=RXN66-313}}
{{#set: consumed or produced by=RXN-13185}}
+

Latest revision as of 19:31, 21 March 2018

Metabolite CPD-4577

  • smiles:
    • CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C([O-])=O)(C)C(O)CCC(C)1C=2CCC(C)34))))
  • common name:
    • 4α-carboxy-4β-methyl-5α-cholesta-8,24-dien-3β-ol
  • inchi key:
    • InChIKey=MYWAIWDQTCHPTH-LJAIZBFVSA-M
  • molecular weight:
    • 441.673
  • Synonym(s):
    • 4β-methyl-4α-carboxy-cholesta-8,24-dien-3β-ol
    • 4β-methylzymosterol-4α-carboxylate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C([O-])=O)(C)C(O)CCC(C)1C=2CCC(C)34))))" cannot be used as a page name in this wiki.