Difference between revisions of "CPD-110"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-110 CPD-110] == * smiles: ** C(C1(=CC=CC=C1O))([O-])=O * inchi key: ** InChIKey=YGSDEFSMJLZ...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C(C1(=CC=CC=C1O))([O-])=O | ** C(C1(=CC=CC=C1O))([O-])=O | ||
| + | * molecular weight: | ||
| + | ** 137.115 | ||
* inchi key: | * inchi key: | ||
** InChIKey=YGSDEFSMJLZEOE-UHFFFAOYSA-M | ** InChIKey=YGSDEFSMJLZEOE-UHFFFAOYSA-M | ||
* common name: | * common name: | ||
** salicylate | ** salicylate | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** salicylic acid | ** salicylic acid | ||
| Line 23: | Line 23: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
| − | |||
| − | |||
* KNAPSACK : C00000206 | * KNAPSACK : C00000206 | ||
| + | * CAS : 69-72-7 | ||
* HMDB : HMDB01895 | * HMDB : HMDB01895 | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.4964.html 4964] | ** [http://www.chemspider.com/Chemical-Structure.4964.html 4964] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=30762 30762] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=30762 30762] | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00805 C00805] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54675850 54675850] | ||
| + | * Wikipedia : Salicylate | ||
{{#set: smiles=C(C1(=CC=CC=C1O))([O-])=O}} | {{#set: smiles=C(C1(=CC=CC=C1O))([O-])=O}} | ||
| + | {{#set: molecular weight=137.115 }} | ||
{{#set: inchi key=InChIKey=YGSDEFSMJLZEOE-UHFFFAOYSA-M}} | {{#set: inchi key=InChIKey=YGSDEFSMJLZEOE-UHFFFAOYSA-M}} | ||
{{#set: common name=salicylate}} | {{#set: common name=salicylate}} | ||
| − | |||
{{#set: common name=salicylic acid|o-hydroxybenzoic acid|2-hydroxybenzoic acid|SA|2-HBA|2-hydroxybenzoate|o-hydroxybenzoate}} | {{#set: common name=salicylic acid|o-hydroxybenzoic acid|2-hydroxybenzoic acid|SA|2-HBA|2-hydroxybenzoate|o-hydroxybenzoate}} | ||
{{#set: produced by=RXNQT-4366}} | {{#set: produced by=RXNQT-4366}} | ||
Latest revision as of 17:07, 9 January 2019
Contents
Metabolite CPD-110
- smiles:
- C(C1(=CC=CC=C1O))([O-])=O
- molecular weight:
- 137.115
- inchi key:
- InChIKey=YGSDEFSMJLZEOE-UHFFFAOYSA-M
- common name:
- salicylate
- Synonym(s):
- salicylic acid
- o-hydroxybenzoic acid
- 2-hydroxybenzoic acid
- SA
- 2-HBA
- 2-hydroxybenzoate
- o-hydroxybenzoate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- KNAPSACK : C00000206
- CAS : 69-72-7
- HMDB : HMDB01895
- CHEMSPIDER:
- CHEBI:
- LIGAND-CPD:
- PUBCHEM:
- Wikipedia : Salicylate
"C(C1(=CC=CC=C1O))([O-])=O" cannot be used as a page name in this wiki.
