Difference between revisions of "CHC T00002502001 1"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-AMINOACRYLATE 2-AMINOACRYLATE] == * smiles: ** C=C(N)C(=O)[O-] * inchi key: ** InChIKey=UQBOJ...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13524 CPD-13524] == * smiles: ** CC(=CC=CC(C)=CCO)C=CC1(=C(C)CCCC(C)(C)1) * inchi key: ** I...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-AMINOACRYLATE 2-AMINOACRYLATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13524 CPD-13524] ==
 
* smiles:
 
* smiles:
−
** C=C(N)C(=O)[O-]
+
** CC(=CC=CC(C)=CCO)C=CC1(=C(C)CCCC(C)(C)1)
 
* inchi key:
 
* inchi key:
−
** InChIKey=UQBOJOOOTLPNST-UHFFFAOYSA-M
+
** InChIKey=FPIPGXGPPPQFEQ-OVSJKPMPSA-N
 
* common name:
 
* common name:
−
** 2-aminoprop-2-enoate
+
** all-trans-retinol
 
* molecular weight:
 
* molecular weight:
−
** 86.07    
+
** 286.456    
 
* Synonym(s):
 
* Synonym(s):
−
** 2-aminoacrylate
+
** trans-retinol
−
** α-aminoacrylate
+
** retinol
−
** 2-aminoacrylic acid
+
** vitamin A
−
** 2,3-didehydroalanine
+
** vitamin A1
−
** α,β-dehydroalanine
+
−
** anhydroserine 2-aminopropenoic acid
+
−
** dehydroalanine
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-15124]]
 
−
* [[RXN-8899]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-15131]]
+
* [[RXN-12575]]
−
* [[RXN-15125]]
+
* [[3.1.1.64-RXN]]
−
* [[RXN-15137]]
+
* [[RXN-12579]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-10841]]
 +
* [[RETINOL-DEHYDROGENASE-RXN]]
 
== External links  ==
 
== External links  ==
 +
* DRUGBANK : DB00162
 +
* CAS : 68-26-8
 +
* CAS : 11103-57-4
 +
* Wikipedia : Retinol
 +
* LIPID_MAPS : LMPR01090001
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=22022579 22022579]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=445354 445354]
 +
* HMDB : HMDB00305
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C00473 C00473]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.10759332.html 10759332]
+
** [http://www.chemspider.com/Chemical-Structure.393012.html 393012]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58020 58020]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17336 17336]
−
* LIGAND-CPD:
+
* METABOLIGHTS : MTBLC17336
−
** [http://www.genome.jp/dbget-bin/www_bget?C02218 C02218]
+
{{#set: smiles=CC(=CC=CC(C)=CCO)C=CC1(=C(C)CCCC(C)(C)1)}}
−
* HMDB : HMDB03609
+
{{#set: inchi key=InChIKey=FPIPGXGPPPQFEQ-OVSJKPMPSA-N}}
−
{{#set: smiles=C=C(N)C(=O)[O-]}}
+
{{#set: common name=all-trans-retinol}}
−
{{#set: inchi key=InChIKey=UQBOJOOOTLPNST-UHFFFAOYSA-M}}
+
{{#set: molecular weight=286.456   }}
−
{{#set: common name=2-aminoprop-2-enoate}}
+
{{#set: common name=trans-retinol|retinol|vitamin A|vitamin A1}}
−
{{#set: molecular weight=86.07   }}
+
{{#set: produced by=RXN-12575|3.1.1.64-RXN|RXN-12579}}
−
{{#set: common name=2-aminoacrylate|α-aminoacrylate|2-aminoacrylic acid|2,3-didehydroalanine|α,β-dehydroalanine|anhydroserine 2-aminopropenoic acid|dehydroalanine}}
+
{{#set: consumed or produced by=RXN-10841|RETINOL-DEHYDROGENASE-RXN}}
−
{{#set: consumed by=RXN-15124|RXN-8899}}
+
−
{{#set: produced by=RXN-15131|RXN-15125|RXN-15137}}
+

Revision as of 10:52, 18 January 2018

Metabolite CPD-13524

  • smiles:
    • CC(=CC=CC(C)=CCO)C=CC1(=C(C)CCCC(C)(C)1)
  • inchi key:
    • InChIKey=FPIPGXGPPPQFEQ-OVSJKPMPSA-N
  • common name:
    • all-trans-retinol
  • molecular weight:
    • 286.456
  • Synonym(s):
    • trans-retinol
    • retinol
    • vitamin A
    • vitamin A1

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • DRUGBANK : DB00162
  • CAS : 68-26-8
  • CAS : 11103-57-4
  • Wikipedia : Retinol
  • LIPID_MAPS : LMPR01090001
  • PUBCHEM:
  • HMDB : HMDB00305
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC17336




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