Difference between revisions of "CPD-12825"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12825 CPD-12825] == * smiles: ** C(C(C(CO)O)O)O * common name: ** D-threitol * inchi key: *...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C(C(C(CO)O)O)O | ** C(C(C(CO)O)O)O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 122.121 | ** 122.121 | ||
| + | * inchi key: | ||
| + | ** InChIKey=UNXHWFMMPAWVPI-QWWZWVQMSA-N | ||
| + | * common name: | ||
| + | ** D-threitol | ||
* Synonym(s): | * Synonym(s): | ||
** (2R,3R)-butane-1,2,3,4-tetrol | ** (2R,3R)-butane-1,2,3,4-tetrol | ||
| Line 19: | Line 19: | ||
* [[ERYTHRULOSE-REDUCTASE-RXN]] | * [[ERYTHRULOSE-REDUCTASE-RXN]] | ||
== External links == | == External links == | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.147828.html 147828] | ||
| + | * REFMET : Threitol | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=169019 169019] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=169019 169019] | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=48300 48300] | ||
* HMDB : HMDB04136 | * HMDB : HMDB04136 | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C16884 C16884] | ** [http://www.genome.jp/dbget-bin/www_bget?C16884 C16884] | ||
| − | |||
| − | |||
| − | |||
| − | |||
* METABOLIGHTS : MTBLC48300 | * METABOLIGHTS : MTBLC48300 | ||
{{#set: smiles=C(C(C(CO)O)O)O}} | {{#set: smiles=C(C(C(CO)O)O)O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=122.121 }} | {{#set: molecular weight=122.121 }} | ||
| + | {{#set: inchi key=InChIKey=UNXHWFMMPAWVPI-QWWZWVQMSA-N}} | ||
| + | {{#set: common name=D-threitol}} | ||
{{#set: common name=(2R,3R)-butane-1,2,3,4-tetrol|D-threo-tetritol}} | {{#set: common name=(2R,3R)-butane-1,2,3,4-tetrol|D-threo-tetritol}} | ||
{{#set: reversible reaction associated=RXN-17773|ERYTHRULOSE-REDUCTASE-RXN}} | {{#set: reversible reaction associated=RXN-17773|ERYTHRULOSE-REDUCTASE-RXN}} | ||
Latest revision as of 14:54, 10 January 2019
Contents
Metabolite CPD-12825
- smiles:
- C(C(C(CO)O)O)O
- molecular weight:
- 122.121
- inchi key:
- InChIKey=UNXHWFMMPAWVPI-QWWZWVQMSA-N
- common name:
- D-threitol
- Synonym(s):
- (2R,3R)-butane-1,2,3,4-tetrol
- D-threo-tetritol
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- REFMET : Threitol
- PUBCHEM:
- CHEBI:
- HMDB : HMDB04136
- LIGAND-CPD:
- METABOLIGHTS : MTBLC48300
