Difference between revisions of "CPD1G-771"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10262 CPD-10262] == * smiles: ** CCCCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10262 CPD-10262] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-771 CPD1G-771] ==
 
* smiles:
 
* smiles:
** CCCCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O
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** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)
 +
* molecular weight:
 +
** 1656.508   
 
* inchi key:
 
* inchi key:
** InChIKey=NBCCUIHOHUKBMK-ZDDAFBBHSA-J
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** InChIKey=NYSGJFYKJQFMRN-ZVNWTMLTSA-L
 
* common name:
 
* common name:
** trans-octadec-2-enoyl-CoA
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** 6-O-cis-methoxy-mycolyl-trehalose 6-phosphate
* molecular weight:
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** 1027.953   
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* Synonym(s):
 
* Synonym(s):
** trans-2,3-dihydro-stearenoyl-CoA
 
** (2E)-octadecenoyl-CoA
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-9546]]
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* [[RXN1G-1436]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C16218 C16218]
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=71412 71412]
 
* BIGG : od2coa
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25244344 25244344]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657776 90657776]
* HMDB : HMDB06529
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{{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)}}
{{#set: smiles=CCCCCCCCCCCCCCCC=CC(=O)SCCNC(=O)CCNC(C(O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OCC1(C(OP(=O)([O-])[O-])C(O)C(O1)N3(C=NC2(C(N)=NC=NC=23))))=O}}
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{{#set: molecular weight=1656.508    }}
{{#set: inchi key=InChIKey=NBCCUIHOHUKBMK-ZDDAFBBHSA-J}}
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{{#set: inchi key=InChIKey=NYSGJFYKJQFMRN-ZVNWTMLTSA-L}}
{{#set: common name=trans-octadec-2-enoyl-CoA}}
+
{{#set: common name=6-O-cis-methoxy-mycolyl-trehalose 6-phosphate}}
{{#set: molecular weight=1027.953    }}
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{{#set: consumed by=RXN1G-1436}}
{{#set: common name=trans-2,3-dihydro-stearenoyl-CoA|(2E)-octadecenoyl-CoA}}
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{{#set: consumed by=RXN-9546}}
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Latest revision as of 16:15, 9 January 2019

Metabolite CPD1G-771

  • smiles:
    • CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)
  • molecular weight:
    • 1656.508
  • inchi key:
    • InChIKey=NYSGJFYKJQFMRN-ZVNWTMLTSA-L
  • common name:
    • 6-O-cis-methoxy-mycolyl-trehalose 6-phosphate
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)" cannot be used as a page name in this wiki.