Difference between revisions of "CPD-7953"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7953 CPD-7953] == * smiles: ** CC(=CC=CC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCCC=1C)(C)C...")
 
Line 3: Line 3:
 
* smiles:
 
* smiles:
 
** CC(=CC=CC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCCC=1C)(C)C))C)C)C)C)C)C
 
** CC(=CC=CC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCCC=1C)(C)C))C)C)C)C)C)C
 +
* molecular weight:
 +
** 534.867   
 
* inchi key:
 
* inchi key:
 
** InChIKey=AIBOHNYYKWYQMM-IQKLXLPLSA-N
 
** InChIKey=AIBOHNYYKWYQMM-IQKLXLPLSA-N
 
* common name:
 
* common name:
 
** torulene
 
** torulene
* molecular weight:
 
** 534.867   
 
 
* Synonym(s):
 
* Synonym(s):
 
** 3',4'-didehydro-β,ψ-carotene
 
** 3',4'-didehydro-β,ψ-carotene
Line 17: Line 17:
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=10218186 10218186]
 
* CHEMSPIDER:
 
** [http://www.chemspider.com/Chemical-Structure.8393678.html 8393678]
 
 
* CHEBI:
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=9638 9638]
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=9638 9638]
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=10218186 10218186]
 
* LIGAND-CPD:
 
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C08613 C08613]
 
** [http://www.genome.jp/dbget-bin/www_bget?C08613 C08613]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.8393678.html 8393678]
 
{{#set: smiles=CC(=CC=CC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCCC=1C)(C)C))C)C)C)C)C)C}}
 
{{#set: smiles=CC(=CC=CC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCCC=1C)(C)C))C)C)C)C)C)C}}
 +
{{#set: molecular weight=534.867    }}
 
{{#set: inchi key=InChIKey=AIBOHNYYKWYQMM-IQKLXLPLSA-N}}
 
{{#set: inchi key=InChIKey=AIBOHNYYKWYQMM-IQKLXLPLSA-N}}
 
{{#set: common name=torulene}}
 
{{#set: common name=torulene}}
{{#set: molecular weight=534.867    }}
 
 
{{#set: common name=3',4'-didehydro-β,ψ-carotene}}
 
{{#set: common name=3',4'-didehydro-β,ψ-carotene}}
 
{{#set: consumed by=RXN-11989}}
 
{{#set: consumed by=RXN-11989}}

Latest revision as of 15:08, 9 January 2019

Metabolite CPD-7953

  • smiles:
    • CC(=CC=CC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1(C(CCCC=1C)(C)C))C)C)C)C)C)C
  • molecular weight:
    • 534.867
  • inchi key:
    • InChIKey=AIBOHNYYKWYQMM-IQKLXLPLSA-N
  • common name:
    • torulene
  • Synonym(s):
    • 3',4'-didehydro-β,ψ-carotene

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links