Difference between revisions of "CPD-14760"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14760 CPD-14760] == * smiles: ** CSCC1(=CC=CO1) * common name: ** furfuryl methyl sulfide *...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CSCC1(=CC=CO1) | ** CSCC1(=CC=CO1) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 128.189 | ** 128.189 | ||
| + | * inchi key: | ||
| + | ** InChIKey=SKSFHXVDHVKIBN-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** furfuryl methyl sulfide | ||
* Synonym(s): | * Synonym(s): | ||
** 2-[(methylthio)methyl]furan | ** 2-[(methylthio)methyl]furan | ||
| Line 18: | Line 18: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.452683.html 452683] | ** [http://www.chemspider.com/Chemical-Structure.452683.html 452683] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=518937 518937] | ||
* HMDB : HMDB32916 | * HMDB : HMDB32916 | ||
| + | * CAS : 1438-91-1 | ||
{{#set: smiles=CSCC1(=CC=CO1)}} | {{#set: smiles=CSCC1(=CC=CO1)}} | ||
| − | |||
| − | |||
{{#set: molecular weight=128.189 }} | {{#set: molecular weight=128.189 }} | ||
| + | {{#set: inchi key=InChIKey=SKSFHXVDHVKIBN-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=furfuryl methyl sulfide}} | ||
{{#set: common name=2-[(methylthio)methyl]furan|2-furfuryl methyl sulfide}} | {{#set: common name=2-[(methylthio)methyl]furan|2-furfuryl methyl sulfide}} | ||
{{#set: produced by=RXN-13727}} | {{#set: produced by=RXN-13727}} | ||
Latest revision as of 14:30, 10 January 2019
Contents
Metabolite CPD-14760
- smiles:
- CSCC1(=CC=CO1)
- molecular weight:
- 128.189
- inchi key:
- InChIKey=SKSFHXVDHVKIBN-UHFFFAOYSA-N
- common name:
- furfuryl methyl sulfide
- Synonym(s):
- 2-[(methylthio)methyl]furan
- 2-furfuryl methyl sulfide
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"2-[(methylthio)methyl]furan" cannot be used as a page name in this wiki.
