Difference between revisions of "HOMOGENTISATE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HOMOGENTISATE HOMOGENTISATE] == * smiles: ** C1(C(=CC(=C(C=1)O)CC([O-])=O)O) * common name: **...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C1(C(=CC(=C(C=1)O)CC([O-])=O)O) | ** C1(C(=CC(=C(C=1)O)CC([O-])=O)O) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 167.141 | ** 167.141 | ||
| + | * inchi key: | ||
| + | ** InChIKey=IGMNYECMUMZDDF-UHFFFAOYSA-M | ||
| + | * common name: | ||
| + | ** homogentisate | ||
* Synonym(s): | * Synonym(s): | ||
** 2,5-dihydroxyphenylacetate | ** 2,5-dihydroxyphenylacetate | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | |||
| − | |||
* [[RXN-2761]] | * [[RXN-2761]] | ||
| + | * [[RXN-14929]] | ||
| + | * [[RXN-2541]] | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
* [[HPPD]] | * [[HPPD]] | ||
| Line 21: | Line 21: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.4573931.html 4573931] | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460389 5460389] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460389 5460389] | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16169 16169] | ||
| + | * GO-TERMS : (REFMET "Homogentisic acid" NIL midford 3701443689 NIL NIL) | ||
* HMDB : HMDB00130 | * HMDB : HMDB00130 | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C00544 C00544] | ** [http://www.genome.jp/dbget-bin/www_bget?C00544 C00544] | ||
| − | |||
| − | |||
| − | |||
| − | |||
* METABOLIGHTS : MTBLC16169 | * METABOLIGHTS : MTBLC16169 | ||
{{#set: smiles=C1(C(=CC(=C(C=1)O)CC([O-])=O)O)}} | {{#set: smiles=C1(C(=CC(=C(C=1)O)CC([O-])=O)O)}} | ||
| − | |||
| − | |||
{{#set: molecular weight=167.141 }} | {{#set: molecular weight=167.141 }} | ||
| + | {{#set: inchi key=InChIKey=IGMNYECMUMZDDF-UHFFFAOYSA-M}} | ||
| + | {{#set: common name=homogentisate}} | ||
{{#set: common name=2,5-dihydroxyphenylacetate}} | {{#set: common name=2,5-dihydroxyphenylacetate}} | ||
| − | {{#set: consumed by=RXN- | + | {{#set: consumed by=RXN-2761|RXN-14929|RXN-2541}} |
{{#set: produced by=HPPD|4-HYDROXYPHENYLPYRUVATE-DIOXYGENASE-RXN}} | {{#set: produced by=HPPD|4-HYDROXYPHENYLPYRUVATE-DIOXYGENASE-RXN}} | ||
Latest revision as of 15:09, 10 January 2019
Contents
Metabolite HOMOGENTISATE
- smiles:
- C1(C(=CC(=C(C=1)O)CC([O-])=O)O)
- molecular weight:
- 167.141
- inchi key:
- InChIKey=IGMNYECMUMZDDF-UHFFFAOYSA-M
- common name:
- homogentisate
- Synonym(s):
- 2,5-dihydroxyphenylacetate
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 "Homogentisic acid" NIL midford 3701443689 NIL NIL)
- HMDB : HMDB00130
- LIGAND-CPD:
- METABOLIGHTS : MTBLC16169
"C1(C(=CC(=C(C=1)O)CC([O-])=O)O)" cannot be used as a page name in this wiki.
