Difference between revisions of "CPD-15163"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15163 CPD-15163] == * smiles: ** C#CC=O * inchi key: ** InChIKey=IJNJLGFTSIAHEA-UHFFFAOYSA-...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15163 CPD-15163] == * smiles: ** C#CC=O * common name: ** prop-2-ynal * inchi key: ** InChI...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C#CC=O | ** C#CC=O | ||
| − | |||
| − | |||
* common name: | * common name: | ||
** prop-2-ynal | ** prop-2-ynal | ||
| + | * inchi key: | ||
| + | ** InChIKey=IJNJLGFTSIAHEA-UHFFFAOYSA-N | ||
* molecular weight: | * molecular weight: | ||
** 54.048 | ** 54.048 | ||
| Line 21: | Line 21: | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C05985 C05985] | ** [http://www.genome.jp/dbget-bin/www_bget?C05985 C05985] | ||
| + | * HMDB : HMDB06803 | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27976 27976] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27976 27976] | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=12222 12222] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=12222 12222] | ||
| − | |||
{{#set: smiles=C#CC=O}} | {{#set: smiles=C#CC=O}} | ||
| − | |||
{{#set: common name=prop-2-ynal}} | {{#set: common name=prop-2-ynal}} | ||
| + | {{#set: inchi key=InChIKey=IJNJLGFTSIAHEA-UHFFFAOYSA-N}} | ||
{{#set: molecular weight=54.048 }} | {{#set: molecular weight=54.048 }} | ||
{{#set: common name=propiolaldehyde|2-propynal|propynal}} | {{#set: common name=propiolaldehyde|2-propynal|propynal}} | ||
{{#set: reversible reaction associated=RXN-14224}} | {{#set: reversible reaction associated=RXN-14224}} | ||
Latest revision as of 19:40, 21 March 2018
Contents
Metabolite CPD-15163
- smiles:
- C#CC=O
- common name:
- prop-2-ynal
- inchi key:
- InChIKey=IJNJLGFTSIAHEA-UHFFFAOYSA-N
- molecular weight:
- 54.048
- Synonym(s):
- propiolaldehyde
- 2-propynal
- propynal
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
