Difference between revisions of "CPD-30"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-30 CPD-30] == * smiles: ** CC(NCCC[CH]=O)=O * common name: ** 4-acetamidobutanal * inchi ke...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC(NCCC[CH]=O)=O | ** CC(NCCC[CH]=O)=O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 129.158 | ** 129.158 | ||
| + | * inchi key: | ||
| + | ** InChIKey=DDSLGZOYEPKPSJ-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** 4-acetamidobutanal | ||
* Synonym(s): | * Synonym(s): | ||
** N-acetyl-γ-aminobutyraldehyde | ** N-acetyl-γ-aminobutyraldehyde | ||
| Line 19: | Line 19: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.389692.html 389692] | ||
| + | * METABOLIGHTS : MTBLC7386 | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=440850 440850] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=440850 440850] | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=7386 7386] | ||
* HMDB : HMDB04226 | * HMDB : HMDB04226 | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C05936 C05936] | ** [http://www.genome.jp/dbget-bin/www_bget?C05936 C05936] | ||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
{{#set: smiles=CC(NCCC[CH]=O)=O}} | {{#set: smiles=CC(NCCC[CH]=O)=O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=129.158 }} | {{#set: molecular weight=129.158 }} | ||
| + | {{#set: inchi key=InChIKey=DDSLGZOYEPKPSJ-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=4-acetamidobutanal}} | ||
{{#set: common name=N-acetyl-γ-aminobutyraldehyde|N-acetyl-4-aminobutanal}} | {{#set: common name=N-acetyl-γ-aminobutyraldehyde|N-acetyl-4-aminobutanal}} | ||
{{#set: consumed by=RXN-37}} | {{#set: consumed by=RXN-37}} | ||
{{#set: produced by=RXN-1}} | {{#set: produced by=RXN-1}} | ||
Latest revision as of 15:39, 10 January 2019
Contents
Metabolite CPD-30
- smiles:
- CC(NCCC[CH]=O)=O
- molecular weight:
- 129.158
- inchi key:
- InChIKey=DDSLGZOYEPKPSJ-UHFFFAOYSA-N
- common name:
- 4-acetamidobutanal
- Synonym(s):
- N-acetyl-γ-aminobutyraldehyde
- N-acetyl-4-aminobutanal
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- METABOLIGHTS : MTBLC7386
- PUBCHEM:
- CHEBI:
- HMDB : HMDB04226
- LIGAND-CPD:
"CC(NCCC[CH]=O)=O" cannot be used as a page name in this wiki.
