Difference between revisions of "CPD-665"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-665 CPD-665] == * smiles: ** CC[CH]=O * common name: ** 1-propanal * inchi key: ** InChIKey...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC[CH]=O | ** CC[CH]=O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 58.08 | ** 58.08 | ||
| + | * inchi key: | ||
| + | ** InChIKey=NBBJYMSMWIIQGU-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** 1-propanal | ||
* Synonym(s): | * Synonym(s): | ||
** propionaldehyde | ** propionaldehyde | ||
| Line 17: | Line 17: | ||
* [[RXN-13198]] | * [[RXN-13198]] | ||
== External links == | == External links == | ||
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| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.512.html 512] | ** [http://www.chemspider.com/Chemical-Structure.512.html 512] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=527 527] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17153 17153] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17153 17153] | ||
| + | * CAS : 123-38-6 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00479 C00479] | ||
| + | * HMDB : HMDB03366 | ||
* BIGG : ppal | * BIGG : ppal | ||
{{#set: smiles=CC[CH]=O}} | {{#set: smiles=CC[CH]=O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=58.08 }} | {{#set: molecular weight=58.08 }} | ||
| + | {{#set: inchi key=InChIKey=NBBJYMSMWIIQGU-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=1-propanal}} | ||
{{#set: common name=propionaldehyde}} | {{#set: common name=propionaldehyde}} | ||
{{#set: reversible reaction associated=RXN-13198}} | {{#set: reversible reaction associated=RXN-13198}} | ||
Latest revision as of 15:03, 10 January 2019
Contents
Metabolite CPD-665
- smiles:
- CC[CH]=O
- molecular weight:
- 58.08
- inchi key:
- InChIKey=NBBJYMSMWIIQGU-UHFFFAOYSA-N
- common name:
- 1-propanal
- Synonym(s):
- propionaldehyde
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- CHEBI:
- CAS : 123-38-6
- LIGAND-CPD:
- HMDB : HMDB03366
- BIGG : ppal
"CC[CH]=O" cannot be used as a page name in this wiki.
