Difference between revisions of "CPD-4101"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10586 CPD-10586] == * smiles: ** CC(CO)CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2C(O)C[CH]4(C(...")
(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...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10586 CPD-10586] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4101 CPD-4101] ==
 
* smiles:
 
* smiles:
** CC(CO)CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2C(O)C[CH]4(C(C)3CCC(O)C4))))
+
** 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))))
 
* common name:
 
* common name:
** (25R)-5β-cholestane-3α,7α,26-triol
+
** 24-methylenelophenol
 
* inchi key:
 
* inchi key:
** InChIKey=OQIJRBFRXGIHMI-WKNWCLFJSA-N
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** InChIKey=RSMKYRDCCSNYFM-AAGDOFLISA-N
 
* molecular weight:
 
* molecular weight:
** 420.674    
+
** 412.698    
 
* Synonym(s):
 
* Synonym(s):
 +
** 4α-methyl-5α-ergosta-7,24-dien-3β-ol
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-9843]]
+
* [[2.1.1.143-RXN]]
 
== 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  ==
* LIPID_MAPS : LMST04030020
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46926093 46926093]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5283640 5283640]
* HMDB : HMDB12455
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?c05444 c05444]
+
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28540 28540]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29107 29107]
* METABOLIGHTS : MTBLC28540
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* LIGAND-CPD:
{{#set: smiles=CC(CO)CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2C(O)C[CH]4(C(C)3CCC(O)C4))))}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C11522 C11522]
{{#set: common name=(25R)-5β-cholestane-3α,7α,26-triol}}
+
{{#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))))}}
{{#set: inchi key=InChIKey=OQIJRBFRXGIHMI-WKNWCLFJSA-N}}
+
{{#set: common name=24-methylenelophenol}}
{{#set: molecular weight=420.674   }}
+
{{#set: inchi key=InChIKey=RSMKYRDCCSNYFM-AAGDOFLISA-N}}
{{#set: consumed by=RXN-9843}}
+
{{#set: molecular weight=412.698   }}
 +
{{#set: common name=4α-methyl-5α-ergosta-7,24-dien-3β-ol}}
 +
{{#set: consumed by=2.1.1.143-RXN}}

Latest revision as of 19:53, 21 March 2018

Metabolite 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]2CCC(C)34))))
  • common name:
    • 24-methylenelophenol
  • inchi key:
    • InChIKey=RSMKYRDCCSNYFM-AAGDOFLISA-N
  • molecular weight:
    • 412.698
  • Synonym(s):
    • 4α-methyl-5α-ergosta-7,24-dien-3β-ol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"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))))" cannot be used as a page name in this wiki.