Difference between revisions of "FERULIC-ACID"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=FERULIC-ACID FERULIC-ACID] == * smiles: ** COC1(=CC(C=CC([O-])=O)=CC=C(O)1) * common name: ** f...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** COC1(=CC(C=CC([O-])=O)=CC=C(O)1) | ** COC1(=CC(C=CC([O-])=O)=CC=C(O)1) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 193.179 | ** 193.179 | ||
| + | * inchi key: | ||
| + | ** InChIKey=KSEBMYQBYZTDHS-HWKANZROSA-M | ||
| + | * common name: | ||
| + | ** ferulate | ||
* Synonym(s): | * Synonym(s): | ||
** ferulic acid | ** ferulic acid | ||
| Line 17: | Line 17: | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | |||
* [[RXN-1121]] | * [[RXN-1121]] | ||
| + | * [[6.2.1.34-RXN]] | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
* [[3.1.1.73-RXN]] | * [[3.1.1.73-RXN]] | ||
| Line 24: | Line 24: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.4573888.html 4573888] | ** [http://www.chemspider.com/Chemical-Structure.4573888.html 4573888] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54691413 54691413] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29749 29749] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29749 29749] | ||
| + | * GO-TERMS : (REFMET "Trans-Ferulic acid" NIL midford 3701443689 NIL NIL) | ||
| + | * CAS : 1135-24-6 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C01494 C01494] | ||
| + | * HMDB : HMDB00954 | ||
* METABOLIGHTS : MTBLC29749 | * METABOLIGHTS : MTBLC29749 | ||
{{#set: smiles=COC1(=CC(C=CC([O-])=O)=CC=C(O)1)}} | {{#set: smiles=COC1(=CC(C=CC([O-])=O)=CC=C(O)1)}} | ||
| − | |||
| − | |||
{{#set: molecular weight=193.179 }} | {{#set: molecular weight=193.179 }} | ||
| + | {{#set: inchi key=InChIKey=KSEBMYQBYZTDHS-HWKANZROSA-M}} | ||
| + | {{#set: common name=ferulate}} | ||
{{#set: common name=ferulic acid|3-methoxy-4-hydroxycinnamic acid|caffeic acid 3-methyl ether|4-hydroxy-3-methoxycinnamic acid|3-methoxy-4-hydroxy-trans-cinnamate}} | {{#set: common name=ferulic acid|3-methoxy-4-hydroxycinnamic acid|caffeic acid 3-methyl ether|4-hydroxy-3-methoxycinnamic acid|3-methoxy-4-hydroxy-trans-cinnamate}} | ||
| − | {{#set: consumed by=6.2.1.34-RXN | + | {{#set: consumed by=RXN-1121|6.2.1.34-RXN}} |
{{#set: produced by=3.1.1.73-RXN|RXN-1104}} | {{#set: produced by=3.1.1.73-RXN|RXN-1104}} | ||
Latest revision as of 13:01, 10 January 2019
Contents
Metabolite FERULIC-ACID
- smiles:
- COC1(=CC(C=CC([O-])=O)=CC=C(O)1)
- molecular weight:
- 193.179
- inchi key:
- InChIKey=KSEBMYQBYZTDHS-HWKANZROSA-M
- common name:
- ferulate
- Synonym(s):
- ferulic acid
- 3-methoxy-4-hydroxycinnamic acid
- caffeic acid 3-methyl ether
- 4-hydroxy-3-methoxycinnamic acid
- 3-methoxy-4-hydroxy-trans-cinnamate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- CHEBI:
- GO-TERMS : (REFMET "Trans-Ferulic acid" NIL midford 3701443689 NIL NIL)
- CAS : 1135-24-6
- LIGAND-CPD:
- HMDB : HMDB00954
- METABOLIGHTS : MTBLC29749
"COC1(=CC(C=CC([O-])=O)=CC=C(O)1)" cannot be used as a page name in this wiki.
