Difference between revisions of "CONIFERYL-ALDEHYDE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CONIFERYL-ALDEHYDE CONIFERYL-ALDEHYDE] == * smiles: ** COC1(=CC(C=CC=O)=CC=C(O)1) * inchi key:...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** COC1(=CC(C=CC=O)=CC=C(O)1) | ** COC1(=CC(C=CC=O)=CC=C(O)1) | ||
| + | * molecular weight: | ||
| + | ** 178.187 | ||
* inchi key: | * inchi key: | ||
** InChIKey=DKZBBWMURDFHNE-NSCUHMNNSA-N | ** InChIKey=DKZBBWMURDFHNE-NSCUHMNNSA-N | ||
* common name: | * common name: | ||
** coniferaldehyde | ** coniferaldehyde | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** 4-hydroxy-3-methoxycinnamaldehyde | ** 4-hydroxy-3-methoxycinnamaldehyde | ||
| Line 19: | Line 19: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| + | * METABOLIGHTS : MTBLC16547 | ||
* CAS : 458-36-6 | * CAS : 458-36-6 | ||
| − | |||
| − | |||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.4444167.html 4444167] | ** [http://www.chemspider.com/Chemical-Structure.4444167.html 4444167] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16547 16547] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16547 16547] | ||
| − | * | + | * LIGAND-CPD: |
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C02666 C02666] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280536 5280536] | ||
{{#set: smiles=COC1(=CC(C=CC=O)=CC=C(O)1)}} | {{#set: smiles=COC1(=CC(C=CC=O)=CC=C(O)1)}} | ||
| + | {{#set: molecular weight=178.187 }} | ||
{{#set: inchi key=InChIKey=DKZBBWMURDFHNE-NSCUHMNNSA-N}} | {{#set: inchi key=InChIKey=DKZBBWMURDFHNE-NSCUHMNNSA-N}} | ||
{{#set: common name=coniferaldehyde}} | {{#set: common name=coniferaldehyde}} | ||
| − | |||
{{#set: common name=4-hydroxy-3-methoxycinnamaldehyde|4-hydroxy-3-methoxycinnamic aldehyde|coniferyl aldehyde}} | {{#set: common name=4-hydroxy-3-methoxycinnamaldehyde|4-hydroxy-3-methoxycinnamic aldehyde|coniferyl aldehyde}} | ||
{{#set: produced by=RXN-1106}} | {{#set: produced by=RXN-1106}} | ||
Latest revision as of 15:31, 9 January 2019
Contents
Metabolite CONIFERYL-ALDEHYDE
- smiles:
- COC1(=CC(C=CC=O)=CC=C(O)1)
- molecular weight:
- 178.187
- inchi key:
- InChIKey=DKZBBWMURDFHNE-NSCUHMNNSA-N
- common name:
- coniferaldehyde
- Synonym(s):
- 4-hydroxy-3-methoxycinnamaldehyde
- 4-hydroxy-3-methoxycinnamic aldehyde
- coniferyl aldehyde
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- METABOLIGHTS : MTBLC16547
- CAS : 458-36-6
- CHEMSPIDER:
- CHEBI:
- LIGAND-CPD:
- PUBCHEM:
