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) * inchi key: ** InC...") |
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| 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: | ||
| + | ** 193.179 | ||
* inchi key: | * inchi key: | ||
** InChIKey=KSEBMYQBYZTDHS-HWKANZROSA-M | ** InChIKey=KSEBMYQBYZTDHS-HWKANZROSA-M | ||
* common name: | * common name: | ||
** ferulate | ** ferulate | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** ferulic acid | ** ferulic acid | ||
| Line 22: | Line 22: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| + | * METABOLIGHTS : MTBLC29749 | ||
* CAS : 1135-24-6 | * CAS : 1135-24-6 | ||
| − | |||
| − | |||
* HMDB : HMDB00954 | * HMDB : HMDB00954 | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.4573888.html 4573888] | ** [http://www.chemspider.com/Chemical-Structure.4573888.html 4573888] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29749 29749] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29749 29749] | ||
| − | * | + | * LIGAND-CPD: |
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C01494 C01494] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54691413 54691413] | ||
{{#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: inchi key=InChIKey=KSEBMYQBYZTDHS-HWKANZROSA-M}} | {{#set: inchi key=InChIKey=KSEBMYQBYZTDHS-HWKANZROSA-M}} | ||
{{#set: common name=ferulate}} | {{#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|RXN-1121}} | {{#set: consumed by=6.2.1.34-RXN|RXN-1121}} | ||
Latest revision as of 16:57, 9 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
- METABOLIGHTS : MTBLC29749
- CAS : 1135-24-6
- HMDB : HMDB00954
- CHEMSPIDER:
- CHEBI:
- LIGAND-CPD:
- PUBCHEM:
"COC1(=CC(C=CC([O-])=O)=CC=C(O)1)" cannot be used as a page name in this wiki.
