Difference between revisions of "BUTANAL"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BUTANAL BUTANAL] == * smiles: ** CCC[CH]=O * common name: ** butan-1-al * inchi key: ** InChIKe...") |
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* smiles: | * smiles: | ||
** CCC[CH]=O | ** CCC[CH]=O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 72.107 | ** 72.107 | ||
| + | * inchi key: | ||
| + | ** InChIKey=ZTQSAGDEMFDKMZ-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** butan-1-al | ||
* Synonym(s): | * Synonym(s): | ||
** butanal | ** butanal | ||
| Line 20: | Line 20: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
* [[RXN-161]] | * [[RXN-161]] | ||
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== External links == | == External links == | ||
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| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.256.html 256] | ** [http://www.chemspider.com/Chemical-Structure.256.html 256] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=261 261] | ||
| + | * REFMET : Butanal | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15743 15743] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15743 15743] | ||
| + | * CAS : 123-72-8 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C01412 C01412] | ||
| + | * HMDB : HMDB03543 | ||
* BIGG : btal | * BIGG : btal | ||
{{#set: smiles=CCC[CH]=O}} | {{#set: smiles=CCC[CH]=O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=72.107 }} | {{#set: molecular weight=72.107 }} | ||
| + | {{#set: inchi key=InChIKey=ZTQSAGDEMFDKMZ-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=butan-1-al}} | ||
{{#set: common name=butanal|butyraldehyde|n-butyraldehyde|1-butanal}} | {{#set: common name=butanal|butyraldehyde|n-butyraldehyde|1-butanal}} | ||
{{#set: consumed by=BTS_LPAREN_nadph_RPAREN_}} | {{#set: consumed by=BTS_LPAREN_nadph_RPAREN_}} | ||
| − | {{#set: reversible reaction associated=RXN-161 | + | {{#set: reversible reaction associated=RXN-161}} |
Latest revision as of 13:16, 10 January 2019
Contents
Metabolite BUTANAL
- smiles:
- CCC[CH]=O
- molecular weight:
- 72.107
- inchi key:
- InChIKey=ZTQSAGDEMFDKMZ-UHFFFAOYSA-N
- common name:
- butan-1-al
- Synonym(s):
- butanal
- butyraldehyde
- n-butyraldehyde
- 1-butanal
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- REFMET : Butanal
- CHEBI:
- CAS : 123-72-8
- LIGAND-CPD:
- HMDB : HMDB03543
- BIGG : btal
"CCC[CH]=O" cannot be used as a page name in this wiki.
