Difference between revisions of "ISOCHORISMATE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ISOCHORISMATE ISOCHORISMATE] == * smiles: ** C=C(C(=O)[O-])OC1(C=CC=C(C1O)C([O-])=O) * inchi ke...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C=C(C(=O)[O-])OC1(C=CC=C(C1O)C([O-])=O) | ** C=C(C(=O)[O-])OC1(C=CC=C(C1O)C([O-])=O) | ||
| + | * molecular weight: | ||
| + | ** 224.17 | ||
* inchi key: | * inchi key: | ||
** InChIKey=NTGWPRCCOQCMGE-YUMQZZPRSA-L | ** InChIKey=NTGWPRCCOQCMGE-YUMQZZPRSA-L | ||
* common name: | * common name: | ||
** isochorismate | ** isochorismate | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** Isochorismic acid | ** Isochorismic acid | ||
| Line 17: | Line 17: | ||
* [[ISOCHORSYN-RXN]] | * [[ISOCHORSYN-RXN]] | ||
== External links == | == External links == | ||
| − | * | + | * BIGG : ichor |
| − | + | ||
| − | + | ||
| − | + | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C00885 C00885] | ** [http://www.genome.jp/dbget-bin/www_bget?C00885 C00885] | ||
| Line 27: | Line 24: | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29780 29780] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=29780 29780] | ||
| − | * | + | * CAS : 22642-82-6 |
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460580 5460580] | ||
| + | * DRUGBANK : DB02793 | ||
{{#set: smiles=C=C(C(=O)[O-])OC1(C=CC=C(C1O)C([O-])=O)}} | {{#set: smiles=C=C(C(=O)[O-])OC1(C=CC=C(C1O)C([O-])=O)}} | ||
| + | {{#set: molecular weight=224.17 }} | ||
{{#set: inchi key=InChIKey=NTGWPRCCOQCMGE-YUMQZZPRSA-L}} | {{#set: inchi key=InChIKey=NTGWPRCCOQCMGE-YUMQZZPRSA-L}} | ||
{{#set: common name=isochorismate}} | {{#set: common name=isochorismate}} | ||
| − | |||
{{#set: common name=Isochorismic acid}} | {{#set: common name=Isochorismic acid}} | ||
{{#set: reversible reaction associated=ISOCHORSYN-RXN}} | {{#set: reversible reaction associated=ISOCHORSYN-RXN}} | ||
Latest revision as of 16:25, 9 January 2019
Contents
Metabolite ISOCHORISMATE
- smiles:
- C=C(C(=O)[O-])OC1(C=CC=C(C1O)C([O-])=O)
- molecular weight:
- 224.17
- inchi key:
- InChIKey=NTGWPRCCOQCMGE-YUMQZZPRSA-L
- common name:
- isochorismate
- Synonym(s):
- Isochorismic acid
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- BIGG : ichor
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- CAS : 22642-82-6
- PUBCHEM:
- DRUGBANK : DB02793
"C=C(C(=O)[O-])OC1(C=CC=C(C1O)C([O-])=O)" cannot be used as a page name in this wiki.
