Difference between revisions of "44-DIMETHYL-824-CHOLESTADIENOL"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=RIBOFLAVIN RIBOFLAVIN] == * smiles: ** CC1(C=C3(C(=CC(C)=1)N(CC(O)C(O)C(O)CO)C2(C(C(=O)[N-]C(=O...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=44-DIMETHYL-824-CHOLESTADIENOL 44-DIMETHYL-824-CHOLESTADIENOL] == * smiles: ** CC(C)=CCCC(C)[CH...")
 
(2 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=RIBOFLAVIN RIBOFLAVIN] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=44-DIMETHYL-824-CHOLESTADIENOL 44-DIMETHYL-824-CHOLESTADIENOL] ==
 
* smiles:
 
* smiles:
−
** CC1(C=C3(C(=CC(C)=1)N(CC(O)C(O)C(O)CO)C2(C(C(=O)[N-]C(=O)N=2)=N3)))
+
** CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)(C)C(O)CCC(C)1C=2CCC(C)34))))
 
* inchi key:
 
* inchi key:
−
** InChIKey=AUNGANRZJHBGPY-SCRDCRAPSA-M
+
** InChIKey=CHGIKSSZNBCNDW-QGBOJXOESA-N
 
* common name:
 
* common name:
−
** riboflavin
+
** 4,4-dimethylzymosterol
 
* molecular weight:
 
* molecular weight:
−
** 375.36    
+
** 412.698    
 
* Synonym(s):
 
* Synonym(s):
−
** vitamin B2
+
** 4,4-dimethyl-8,24-cholestadienol
 +
** 4,4-dimethyl-5α-cholesta-8,24-dien-3β-ol
 +
** 14-demethyllanosterol
 +
** 17-(1,5-dimethylhex-4-enyl)-4,4,10,13-tetramethyl-2,3,4,5,6,7, 10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a] phenanthren-3-ol
 +
** 4,4-dimethyl-5α-cholesta-8,24-dien-3-β-ol
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RIBOFLAVINKIN-RXN]]
 
−
* [[RXN-12445]]
 
−
* [[NADPH-DEHYDROGENASE-FLAVIN-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RIBOFLAVIN-SYN-RXN]]
+
* [[RXN66-306]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* CAS : 83-88-5
 
−
* PUBCHEM:
 
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45480541 45480541]
 
−
* HMDB : HMDB00244
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C00255 C00255]
+
** [http://www.genome.jp/dbget-bin/www_bget?C05108 C05108]
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.108964.html 108964]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57986 57986]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18364 18364]
−
* BIGG : 34409
+
* METABOLIGHTS : MTBLC18364
−
{{#set: smiles=CC1(C=C3(C(=CC(C)=1)N(CC(O)C(O)C(O)CO)C2(C(C(=O)[N-]C(=O)N=2)=N3)))}}
+
* PUBCHEM:
−
{{#set: inchi key=InChIKey=AUNGANRZJHBGPY-SCRDCRAPSA-M}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=165609 165609]
−
{{#set: common name=riboflavin}}
+
* HMDB : HMDB01286
−
{{#set: molecular weight=375.36   }}
+
{{#set: smiles=CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)(C)C(O)CCC(C)1C=2CCC(C)34))))}}
−
{{#set: common name=vitamin B2}}
+
{{#set: inchi key=InChIKey=CHGIKSSZNBCNDW-QGBOJXOESA-N}}
−
{{#set: consumed by=RIBOFLAVINKIN-RXN|RXN-12445|NADPH-DEHYDROGENASE-FLAVIN-RXN}}
+
{{#set: common name=4,4-dimethylzymosterol}}
−
{{#set: produced by=RIBOFLAVIN-SYN-RXN}}
+
{{#set: molecular weight=412.698   }}
 +
{{#set: common name=4,4-dimethyl-8,24-cholestadienol|4,4-dimethyl-5α-cholesta-8,24-dien-3β-ol|14-demethyllanosterol|17-(1,5-dimethylhex-4-enyl)-4,4,10,13-tetramethyl-2,3,4,5,6,7, 10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a] phenanthren-3-ol|4,4-dimethyl-5α-cholesta-8,24-dien-3-β-ol}}
 +
{{#set: produced by=RXN66-306}}

Latest revision as of 19:40, 21 March 2018

Metabolite 44-DIMETHYL-824-CHOLESTADIENOL

  • smiles:
    • CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)(C)C(O)CCC(C)1C=2CCC(C)34))))
  • inchi key:
    • InChIKey=CHGIKSSZNBCNDW-QGBOJXOESA-N
  • common name:
    • 4,4-dimethylzymosterol
  • molecular weight:
    • 412.698
  • Synonym(s):
    • 4,4-dimethyl-8,24-cholestadienol
    • 4,4-dimethyl-5α-cholesta-8,24-dien-3β-ol
    • 14-demethyllanosterol
    • 17-(1,5-dimethylhex-4-enyl)-4,4,10,13-tetramethyl-2,3,4,5,6,7, 10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a] phenanthren-3-ol
    • 4,4-dimethyl-5α-cholesta-8,24-dien-3-β-ol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC18364
  • PUBCHEM:
  • HMDB : HMDB01286
"CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C)(C)C(O)CCC(C)1C=2CCC(C)34))))" cannot be used as a page name in this wiki.


"17-(1,5-dimethylhex-4-enyl)-4,4,10,13-tetramethyl-2,3,4,5,6,7, 10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a] phenanthren-3-ol" cannot be used as a page name in this wiki.
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