Difference between revisions of "R310-RXN"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-31 CPD-31] == * smiles: ** CC(O)(C(=O)[O-])CC(=O)[O-] * inchi key: ** InChIKey=XFTRTWQBIOMV...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7422 CPD-7422] == * smiles: ** CC(=CCCC(=CCCC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCC=C1C)(C)C))...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-31 CPD-31] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7422 CPD-7422] ==
 
* smiles:
 
* smiles:
−
** CC(O)(C(=O)[O-])CC(=O)[O-]
+
** CC(=CCCC(=CCCC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCC=C1C)(C)C))C)C)C)C)C)C
 
* inchi key:
 
* inchi key:
−
** InChIKey=XFTRTWQBIOMVPK-RXMQYKEDSA-L
+
** InChIKey=IGABZIVJSNQMPZ-DWQNOKSTSA-N
 
* common name:
 
* common name:
−
** (R)-citramalate
+
** α-zeacarotene
 
* molecular weight:
 
* molecular weight:
−
** 146.099    
+
** 538.898    
 
* Synonym(s):
 
* Synonym(s):
−
** (R)-2-methylmalic acid
 
−
** (3R)-citramalate
 
−
** (3R)-citramalic acid
 
−
** (3R)-α-hydroxypyrotartaric acid
 
−
** D-citramalate
 
−
** D-citramalic acid
 
−
** D-α-hydroxypyrotartaric acid
 
−
** (R)-2-methylmalate
 
−
** (R)-(-)-citramalic acid
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-7743]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-8040]]
 
== External links  ==
 
== External links  ==
−
* CAS : 6236-10-8
+
* LIPID_MAPS : LMPR01070285
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460281 5460281]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6441660 6441660]
 +
* HMDB : HMDB36909
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C14146 C14146]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.4573870.html 4573870]
+
** [http://www.chemspider.com/Chemical-Structure.4945802.html 4945802]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=30934 30934]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=35063 35063]
−
* LIGAND-CPD:
+
{{#set: smiles=CC(=CCCC(=CCCC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCC=C1C)(C)C))C)C)C)C)C)C}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C02612 C02612]
+
{{#set: inchi key=InChIKey=IGABZIVJSNQMPZ-DWQNOKSTSA-N}}
−
{{#set: smiles=CC(O)(C(=O)[O-])CC(=O)[O-]}}
+
{{#set: common name=α-zeacarotene}}
−
{{#set: inchi key=InChIKey=XFTRTWQBIOMVPK-RXMQYKEDSA-L}}
+
{{#set: molecular weight=538.898   }}
−
{{#set: common name=(R)-citramalate}}
+
{{#set: consumed or produced by=RXN-8040}}
−
{{#set: molecular weight=146.099   }}
+
−
{{#set: common name=(R)-2-methylmalic acid|(3R)-citramalate|(3R)-citramalic acid|(3R)-α-hydroxypyrotartaric acid|D-citramalate|D-citramalic acid|D-α-hydroxypyrotartaric acid|(R)-2-methylmalate|(R)-(-)-citramalic acid}}
+
−
{{#set: produced by=RXN-7743}}
+

Revision as of 17:06, 10 January 2018

Metabolite CPD-7422

  • smiles:
    • CC(=CCCC(=CCCC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCC=C1C)(C)C))C)C)C)C)C)C
  • inchi key:
    • InChIKey=IGABZIVJSNQMPZ-DWQNOKSTSA-N
  • common name:
    • α-zeacarotene
  • molecular weight:
    • 538.898
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links



Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=R310-RXN&oldid=16201"