Difference between revisions of "CPD1F-118"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14443 CPD-14443] == * smiles: ** C1(C(O)CC(=NC1C([O-])=O)C([O-])=O) * inchi key: ** InChIKe...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-118 CPD1F-118] == * smiles: ** CC(=CC=CC=C(C=CC=C(C=CC1(=C(CCCC1(C)C)C))C)C)C=CC=C(C=CC2(...")
 
(4 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14443 CPD-14443] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-118 CPD1F-118] ==
 
* smiles:
 
* smiles:
** C1(C(O)CC(=NC1C([O-])=O)C([O-])=O)
+
** CC(=CC=CC=C(C=CC=C(C=CC1(=C(CCCC1(C)C)C))C)C)C=CC=C(C=CC2(C(=CCCC2(C)C)C))C
* inchi key:
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** InChIKey=DVTPRYHENFBCII-IMJSIDKUSA-L
+
 
* common name:
 
* common name:
** (2S,4S)-4-hydroxy-2,3,4,5-tetrahydrodipicolinate
+
** α-carotene
 +
* inchi key:
 +
** InChIKey=ANVAOWXLWRTKGA-JLTXGRSLSA-N
 
* molecular weight:
 
* molecular weight:
** 185.136    
+
** 536.882    
 
* Synonym(s):
 
* Synonym(s):
** (4S)-4-hydroxy-2,3,4,5-tetrahydro-(2S)-dipicolinate
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-14014]]
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* [[RXN-5961]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[DIHYDRODIPICSYN-RXN]]
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* [[RXN1F-148]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* LIPID_MAPS : LMPR01070258
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=70678847 70678847]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4369188 4369188]
 +
* HMDB : HMDB03993
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C05433 C05433]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.3571861.html 3571861]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=67139 67139]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28425 28425]
{{#set: smiles=C1(C(O)CC(=NC1C([O-])=O)C([O-])=O)}}
+
{{#set: smiles=CC(=CC=CC=C(C=CC=C(C=CC1(=C(CCCC1(C)C)C))C)C)C=CC=C(C=CC2(C(=CCCC2(C)C)C))C}}
{{#set: inchi key=InChIKey=DVTPRYHENFBCII-IMJSIDKUSA-L}}
+
{{#set: common name=α-carotene}}
{{#set: common name=(2S,4S)-4-hydroxy-2,3,4,5-tetrahydrodipicolinate}}
+
{{#set: inchi key=InChIKey=ANVAOWXLWRTKGA-JLTXGRSLSA-N}}
{{#set: molecular weight=185.136   }}
+
{{#set: molecular weight=536.882   }}
{{#set: common name=(4S)-4-hydroxy-2,3,4,5-tetrahydro-(2S)-dipicolinate}}
+
{{#set: consumed by=RXN-5961}}
{{#set: consumed by=RXN-14014}}
+
{{#set: produced by=RXN1F-148}}
{{#set: produced by=DIHYDRODIPICSYN-RXN}}
+

Latest revision as of 19:49, 21 March 2018

Metabolite CPD1F-118

  • smiles:
    • CC(=CC=CC=C(C=CC=C(C=CC1(=C(CCCC1(C)C)C))C)C)C=CC=C(C=CC2(C(=CCCC2(C)C)C))C
  • common name:
    • α-carotene
  • inchi key:
    • InChIKey=ANVAOWXLWRTKGA-JLTXGRSLSA-N
  • molecular weight:
    • 536.882
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links