Difference between revisions of "CPD-6992"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4101 CPD-4101] == * smiles: ** CC(C)C(=C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(C(C)C(O)CCC(C)1[CH...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6992 CPD-6992] == * smiles: ** C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3) * common...")
 
(3 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-4101 CPD-4101] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6992 CPD-6992] ==
 
* smiles:
 
* smiles:
** CC(C)C(=C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(C(C)C(O)CCC(C)1[CH]2CCC(C)34))))
+
** C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3)
* inchi key:
+
** InChIKey=RSMKYRDCCSNYFM-AAGDOFLISA-N
+
 
* common name:
 
* common name:
** 24-methylenelophenol
+
** (+)-pinobanksin
 +
* inchi key:
 +
** InChIKey=SUYJZKRQHBQNCA-LSDHHAIUSA-M
 
* molecular weight:
 
* molecular weight:
** 412.698    
+
** 271.249    
 
* Synonym(s):
 
* Synonym(s):
** 4α-methyl-5α-ergosta-7,24-dien-3β-ol
+
** (2R,3R)-pinobanksin
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[2.1.1.143-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-7648]]
 
== 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=5283640 5283640]
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29107 29107]
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C11522 C11522]
+
** [http://www.genome.jp/dbget-bin/www_bget?C09826 C09826]
{{#set: smiles=CC(C)C(=C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(C(C)C(O)CCC(C)1[CH]2CCC(C)34))))}}
+
* HMDB : HMDB37506
{{#set: inchi key=InChIKey=RSMKYRDCCSNYFM-AAGDOFLISA-N}}
+
* CHEBI:
{{#set: common name=24-methylenelophenol}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28103 28103]
{{#set: molecular weight=412.698   }}
+
* METABOLIGHTS : MTBLC28103
{{#set: common name=4α-methyl-5α-ergosta-7,24-dien-3β-ol}}
+
* PUBCHEM:
{{#set: consumed by=2.1.1.143-RXN}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25200970 25200970]
 +
{{#set: smiles=C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3)}}
 +
{{#set: common name=(+)-pinobanksin}}
 +
{{#set: inchi key=InChIKey=SUYJZKRQHBQNCA-LSDHHAIUSA-M}}
 +
{{#set: molecular weight=271.249   }}
 +
{{#set: common name=(2R,3R)-pinobanksin}}
 +
{{#set: produced by=RXN-7648}}

Latest revision as of 19:53, 21 March 2018

Metabolite CPD-6992

  • smiles:
    • C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3)
  • common name:
    • (+)-pinobanksin
  • inchi key:
    • InChIKey=SUYJZKRQHBQNCA-LSDHHAIUSA-M
  • molecular weight:
    • 271.249
  • Synonym(s):
    • (2R,3R)-pinobanksin

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIGAND-CPD:
  • HMDB : HMDB37506
  • CHEBI:
  • METABOLIGHTS : MTBLC28103
  • PUBCHEM:
"C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2O)=O)O)[O-])))=CC=3)" cannot be used as a page name in this wiki.