Difference between revisions of "PHESYN"

Revision as of 10:47, 18 January 2018

"CC(C)C[CH]=O" cannot be used as a page name in this wiki.

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 [[Category:Metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=R-3-hydroxypetroselinoyl-ACPs R-3-hydroxypetroselinoyl-ACPs] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7031 CPD-7031] ==
+* smiles:
+** CC(C)C[CH]=O
+* inchi key:
+** InChIKey=YGHRJJRRZDOVPD-UHFFFAOYSA-N
 * common name:
-** a (3R)-3-hydroxypetroselinoyl-[acp]
+** 3-methylbutanal
+* molecular weight:
+** 86.133
 * Synonym(s):
+** isovaleraldehyde
+** isoamylaldehyde
+** isopentaldehyde
 == Reaction(s) known to consume the compound ==
 == Reaction(s) known to produce the compound ==
-* [[RXN-9552]]
+* [[RXN-7692]]
 == Reaction(s) of unknown directionality ==
+* [[RXN-7693]]
 == External links  ==
-{{#set: common name=a (3R)-3-hydroxypetroselinoyl-[acp]}}
+* PUBCHEM:
-{{#set: produced by=RXN-9552}}
+** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=11552 11552]
+* CHEMSPIDER:
+** [http://www.chemspider.com/Chemical-Structure.11065.html 11065]
+* CHEBI:
+** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16638 16638]
+* LIGAND-CPD:
+** [http://www.genome.jp/dbget-bin/www_bget?C07329 C07329]
+* HMDB : HMDB06478
+{{#set: smiles=CC(C)C[CH]=O}}
+{{#set: inchi key=InChIKey=YGHRJJRRZDOVPD-UHFFFAOYSA-N}}
+{{#set: common name=3-methylbutanal}}
+{{#set: molecular weight=86.133    }}
+{{#set: common name=isovaleraldehyde|isoamylaldehyde|isopentaldehyde}}
+{{#set: produced by=RXN-7692}}
+{{#set: consumed or produced by=RXN-7693}}