Difference between revisions of "CPD-13040"
From metabolic_network
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=APYRASE-RXN APYRASE-RXN] == * direction: ** LEFT-TO-RIGHT * common name: ** ORF * ec number: ** [ht...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13040 CPD-13040] == * smiles: ** CCCC(OCC(OC(CCC)=O)CO)=O * inchi key: ** InChIKey=AWHAUPZH...") |
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| − | [[Category: | + | [[Category:Metabolite]] |
| − | == | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13040 CPD-13040] == |
| − | * | + | * smiles: |
| − | ** | + | ** CCCC(OCC(OC(CCC)=O)CO)=O |
| + | * inchi key: | ||
| + | ** InChIKey=AWHAUPZHZYUHOM-VIFPVBQESA-N | ||
* common name: | * common name: | ||
| − | ** | + | ** 1,2-dibutyrin |
| − | * | + | * molecular weight: |
| − | ** | + | ** 232.276 |
* Synonym(s): | * Synonym(s): | ||
| + | ** glycerol 1,2-dibutanoate | ||
| + | ** β-dibutyrin | ||
| + | ** butanoic acid, 1-(hydroxymethyl)-1,2-ethanediyl ester | ||
| + | ** dibutyrylglycerol | ||
| − | == Reaction | + | == Reaction(s) known to consume the compound == |
| − | + | == Reaction(s) known to produce the compound == | |
| − | + | * [[RXN-12086]] | |
| − | + | == Reaction(s) of unknown directionality == | |
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| − | * [[ | + | |
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| − | == | + | |
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== External links == | == External links == | ||
| − | * | + | * CAS : 24814-35-5 |
| − | ** [http:// | + | * PUBCHEM: |
| − | * | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5327007 5327007] |
| − | ** [http://www. | + | * CHEMSPIDER: |
| − | * | + | ** [http://www.chemspider.com/Chemical-Structure.8352519.html 8352519] |
| − | ** [http://www. | + | * CHEBI: |
| − | {{#set: | + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=76537 76537] |
| − | + | {{#set: smiles=CCCC(OCC(OC(CCC)=O)CO)=O}} | |
| − | + | {{#set: inchi key=InChIKey=AWHAUPZHZYUHOM-VIFPVBQESA-N}} | |
| − | {{#set: | + | {{#set: common name=1,2-dibutyrin}} |
| − | + | {{#set: molecular weight=232.276 }} | |
| − | {{#set: | + | {{#set: common name=glycerol 1,2-dibutanoate|β-dibutyrin|butanoic acid, 1-(hydroxymethyl)-1,2-ethanediyl ester|dibutyrylglycerol}} |
| − | {{#set: | + | {{#set: produced by=RXN-12086}} |
| − | {{#set: | + | |
| − | {{#set: | + | |
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Revision as of 18:44, 18 March 2018
Contents
Metabolite CPD-13040
- smiles:
- CCCC(OCC(OC(CCC)=O)CO)=O
- inchi key:
- InChIKey=AWHAUPZHZYUHOM-VIFPVBQESA-N
- common name:
- 1,2-dibutyrin
- molecular weight:
- 232.276
- Synonym(s):
- glycerol 1,2-dibutanoate
- β-dibutyrin
- butanoic acid, 1-(hydroxymethyl)-1,2-ethanediyl ester
- dibutyrylglycerol
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
