Difference between revisions of "CPD-12699"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12699 CPD-12699] == * smiles: ** CCC(C)(O)C#N * inchi key: ** InChIKey=VMEHOTODTPXCKT-YFKPB...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CCC(C)(O)C#N | ** CCC(C)(O)C#N | ||
| + | * molecular weight: | ||
| + | ** 99.132 | ||
* inchi key: | * inchi key: | ||
** InChIKey=VMEHOTODTPXCKT-YFKPBYRVSA-N | ** InChIKey=VMEHOTODTPXCKT-YFKPBYRVSA-N | ||
* common name: | * common name: | ||
** (2R)-2-hydroxy-2-methylbutanenitrile | ** (2R)-2-hydroxy-2-methylbutanenitrile | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
| Line 19: | Line 19: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=49859714 49859714] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=49859714 49859714] | ||
{{#set: smiles=CCC(C)(O)C#N}} | {{#set: smiles=CCC(C)(O)C#N}} | ||
| + | {{#set: molecular weight=99.132 }} | ||
{{#set: inchi key=InChIKey=VMEHOTODTPXCKT-YFKPBYRVSA-N}} | {{#set: inchi key=InChIKey=VMEHOTODTPXCKT-YFKPBYRVSA-N}} | ||
{{#set: common name=(2R)-2-hydroxy-2-methylbutanenitrile}} | {{#set: common name=(2R)-2-hydroxy-2-methylbutanenitrile}} | ||
| − | |||
{{#set: produced by=RXN-9674}} | {{#set: produced by=RXN-9674}} | ||
Latest revision as of 17:14, 9 January 2019
Contents
Metabolite CPD-12699
- smiles:
- CCC(C)(O)C#N
- molecular weight:
- 99.132
- inchi key:
- InChIKey=VMEHOTODTPXCKT-YFKPBYRVSA-N
- common name:
- (2R)-2-hydroxy-2-methylbutanenitrile
- Synonym(s):
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
