Difference between revisions of "CPD-16819"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-16819 CPD-16819] == * smiles: ** CC1(C=CC(=CC=1)OS(=O)(=O)[O-]) * common name: ** 4-methylp...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC1(C=CC(=CC=1)OS(=O)(=O)[O-]) | ** CC1(C=CC(=CC=1)OS(=O)(=O)[O-]) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 187.19 | ** 187.19 | ||
| + | * inchi key: | ||
| + | ** InChIKey=WGNAKZGUSRVWRH-UHFFFAOYSA-M | ||
| + | * common name: | ||
| + | ** 4-methylphenyl sulfate | ||
* Synonym(s): | * Synonym(s): | ||
** p-cresol sulfate | ** p-cresol sulfate | ||
| Line 17: | Line 17: | ||
* [[RXN-15588]] | * [[RXN-15588]] | ||
== External links == | == External links == | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=133670 133670] | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4615422 4615422] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4615422 4615422] | ||
| + | * HMDB : HMDB11635 | ||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.3806481.html 3806481] | ** [http://www.chemspider.com/Chemical-Structure.3806481.html 3806481] | ||
| − | * | + | * GO-TERMS : (REFMET "P-Cresol sulfate" NIL midford 3701443689 NIL NIL) |
{{#set: smiles=CC1(C=CC(=CC=1)OS(=O)(=O)[O-])}} | {{#set: smiles=CC1(C=CC(=CC=1)OS(=O)(=O)[O-])}} | ||
| − | |||
| − | |||
{{#set: molecular weight=187.19 }} | {{#set: molecular weight=187.19 }} | ||
| + | {{#set: inchi key=InChIKey=WGNAKZGUSRVWRH-UHFFFAOYSA-M}} | ||
| + | {{#set: common name=4-methylphenyl sulfate}} | ||
{{#set: common name=p-cresol sulfate}} | {{#set: common name=p-cresol sulfate}} | ||
{{#set: reversible reaction associated=RXN-15588}} | {{#set: reversible reaction associated=RXN-15588}} | ||
Latest revision as of 11:34, 10 January 2019
Contents
Metabolite CPD-16819
- smiles:
- CC1(C=CC(=CC=1)OS(=O)(=O)[O-])
- molecular weight:
- 187.19
- inchi key:
- InChIKey=WGNAKZGUSRVWRH-UHFFFAOYSA-M
- common name:
- 4-methylphenyl sulfate
- Synonym(s):
- p-cresol sulfate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEBI:
- PUBCHEM:
- HMDB : HMDB11635
- CHEMSPIDER:
- GO-TERMS : (REFMET "P-Cresol sulfate" NIL midford 3701443689 NIL NIL)
"CC1(C=CC(=CC=1)OS(=O)(=O)[O-])" cannot be used as a page name in this wiki.
