Difference between revisions of "BUTANEDIOL"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BUTANEDIOL BUTANEDIOL] == * smiles: ** CC(C(O)C)O * common name: ** (R,R)-2,3-butanediol * inch...") |
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* smiles: | * smiles: | ||
** CC(C(O)C)O | ** CC(C(O)C)O | ||
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| − | |||
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* molecular weight: | * molecular weight: | ||
** 90.122 | ** 90.122 | ||
| + | * inchi key: | ||
| + | ** InChIKey=OWBTYPJTUOEWEK-QWWZWVQMSA-N | ||
| + | * common name: | ||
| + | ** (R,R)-2,3-butanediol | ||
* Synonym(s): | * Synonym(s): | ||
** D(-)-2,3-butanediol | ** D(-)-2,3-butanediol | ||
| Line 22: | Line 22: | ||
* [[RR-BUTANEDIOL-DEHYDROGENASE-RXN]] | * [[RR-BUTANEDIOL-DEHYDROGENASE-RXN]] | ||
== External links == | == External links == | ||
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* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.196452.html 196452] | ** [http://www.chemspider.com/Chemical-Structure.196452.html 196452] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=225936 225936] | ||
| + | * DRUGBANK : DB02418 | ||
| + | * REFMET : 2,3-Butanediol | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16982 16982] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16982 16982] | ||
| + | * CAS : 24347-58-8 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C03044 C03044] | ||
| + | * HMDB : HMDB33007 | ||
{{#set: smiles=CC(C(O)C)O}} | {{#set: smiles=CC(C(O)C)O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=90.122 }} | {{#set: molecular weight=90.122 }} | ||
| + | {{#set: inchi key=InChIKey=OWBTYPJTUOEWEK-QWWZWVQMSA-N}} | ||
| + | {{#set: common name=(R,R)-2,3-butanediol}} | ||
{{#set: common name=D(-)-2,3-butanediol|2,3-butylene glycol|2,3-butanediol|butanediol|(R,R)-butane-2,3-diol|(R,R)-2,3-butylene glycol}} | {{#set: common name=D(-)-2,3-butanediol|2,3-butylene glycol|2,3-butanediol|butanediol|(R,R)-butane-2,3-diol|(R,R)-2,3-butylene glycol}} | ||
{{#set: reversible reaction associated=RR-BUTANEDIOL-DEHYDROGENASE-RXN}} | {{#set: reversible reaction associated=RR-BUTANEDIOL-DEHYDROGENASE-RXN}} | ||
Latest revision as of 15:23, 10 January 2019
Contents
Metabolite BUTANEDIOL
- smiles:
- CC(C(O)C)O
- molecular weight:
- 90.122
- inchi key:
- InChIKey=OWBTYPJTUOEWEK-QWWZWVQMSA-N
- common name:
- (R,R)-2,3-butanediol
- Synonym(s):
- D(-)-2,3-butanediol
- 2,3-butylene glycol
- 2,3-butanediol
- butanediol
- (R,R)-butane-2,3-diol
- (R,R)-2,3-butylene glycol
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- DRUGBANK : DB02418
- REFMET : 2,3-Butanediol
- CHEBI:
- CAS : 24347-58-8
- LIGAND-CPD:
- HMDB : HMDB33007
