Difference between revisions of "PHENYLACETALDEHYDE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHENYLACETALDEHYDE PHENYLACETALDEHYDE] == * smiles: ** [CH](=O)CC1(=CC=CC=C1) * common name: **...") |
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* smiles: | * smiles: | ||
** [CH](=O)CC1(=CC=CC=C1) | ** [CH](=O)CC1(=CC=CC=C1) | ||
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| − | |||
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* molecular weight: | * molecular weight: | ||
** 120.151 | ** 120.151 | ||
| + | * inchi key: | ||
| + | ** InChIKey=DTUQWGWMVIHBKE-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** phenylacetaldehyde | ||
* Synonym(s): | * Synonym(s): | ||
** 2-phenylacetaldehyde | ** 2-phenylacetaldehyde | ||
| Line 21: | Line 21: | ||
* [[RXN-10817]] | * [[RXN-10817]] | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
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== External links == | == External links == | ||
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* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.13876539.html 13876539] | ** [http://www.chemspider.com/Chemical-Structure.13876539.html 13876539] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16424 16424] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16424 16424] | ||
| + | * DRUGBANK : DB02178 | ||
| + | * REFMET : Phenylacetaldehyde | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=998 998] | ||
* METABOLIGHTS : MTBLC16424 | * METABOLIGHTS : MTBLC16424 | ||
| + | * CAS : 122-78-1 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00601 C00601] | ||
| + | * HMDB : HMDB06236 | ||
| + | * BIGG : pacald | ||
{{#set: smiles=[CH](=O)CC1(=CC=CC=C1)}} | {{#set: smiles=[CH](=O)CC1(=CC=CC=C1)}} | ||
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| − | |||
{{#set: molecular weight=120.151 }} | {{#set: molecular weight=120.151 }} | ||
| + | {{#set: inchi key=InChIKey=DTUQWGWMVIHBKE-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=phenylacetaldehyde}} | ||
{{#set: common name=2-phenylacetaldehyde|PAA|α-tolualdehyde|hyacinthin|phenylethanal}} | {{#set: common name=2-phenylacetaldehyde|PAA|α-tolualdehyde|hyacinthin|phenylethanal}} | ||
{{#set: consumed by=RXN-7700}} | {{#set: consumed by=RXN-7700}} | ||
{{#set: produced by=RXN-10817}} | {{#set: produced by=RXN-10817}} | ||
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Latest revision as of 13:52, 10 January 2019
Contents
Metabolite PHENYLACETALDEHYDE
- smiles:
- [CH](=O)CC1(=CC=CC=C1)
- molecular weight:
- 120.151
- inchi key:
- InChIKey=DTUQWGWMVIHBKE-UHFFFAOYSA-N
- common name:
- phenylacetaldehyde
- Synonym(s):
- 2-phenylacetaldehyde
- PAA
- α-tolualdehyde
- hyacinthin
- phenylethanal
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- CHEBI:
- DRUGBANK : DB02178
- REFMET : Phenylacetaldehyde
- PUBCHEM:
- METABOLIGHTS : MTBLC16424
- CAS : 122-78-1
- LIGAND-CPD:
- HMDB : HMDB06236
- BIGG : pacald
"CH](=O)CC1(=CC=CC=C1)" cannot be used as a page name in this wiki.
