Difference between revisions of "CPD-9700"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-139 CPD1F-139] == * smiles: ** C=C1(C3(O)(CC4(C1)(C([CH]5(C2(C(=O)OC(CCC(O)2)([CH](CC3)4)...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACET ACET] == * smiles: ** CC([O-])=O * inchi key: ** InChIKey=QTBSBXVTEAMEQO-UHFFFAOYSA-M * co...") |
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| Line 1: | Line 1: | ||
[[Category:Metabolite]] | [[Category:Metabolite]] | ||
| − | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object= | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACET ACET] == |
* smiles: | * smiles: | ||
| − | ** | + | ** CC([O-])=O |
* inchi key: | * inchi key: | ||
| − | ** InChIKey= | + | ** InChIKey=QTBSBXVTEAMEQO-UHFFFAOYSA-M |
* common name: | * common name: | ||
| − | ** | + | ** acetate |
* molecular weight: | * molecular weight: | ||
| − | ** | + | ** 59.044 |
* Synonym(s): | * Synonym(s): | ||
| − | ** | + | ** acetic acid |
| − | ** | + | ** ethanoic acid |
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | * [[ | + | * [[ACETATE--COA-LIGASE-RXN]] |
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
| + | * [[RXN66-3]] | ||
| + | * [[RXN0-3962]] | ||
| + | * [[RXN-12726]] | ||
| + | * [[3.1.1.47-RXN]] | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| + | * [[3.5.1.98-RXN]] | ||
| + | * [[SULFOCYS-RXN]] | ||
| + | * [[ACETYLORNDEACET-RXN]] | ||
| + | * [[RXN-14728]] | ||
| + | * [[ACSERLY-RXN]] | ||
| + | * [[RXN-1744]] | ||
== External links == | == External links == | ||
| + | * CAS : 64-19-7 | ||
| + | * CAS : 71-50-1 | ||
| + | * BIGG : 33590 | ||
| + | * DRUGBANK : DB03166 | ||
* PUBCHEM: | * PUBCHEM: | ||
| − | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid= | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=175 175] |
| − | * | + | * HMDB : HMDB00042 |
| − | + | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
| − | ** [http://www.genome.jp/dbget-bin/www_bget? | + | ** [http://www.genome.jp/dbget-bin/www_bget?C00033 C00033] |
| − | {{#set: smiles= | + | * CHEMSPIDER: |
| − | {{#set: inchi key=InChIKey= | + | ** [http://www.chemspider.com/Chemical-Structure.170.html 170] |
| − | {{#set: common name= | + | * CHEBI: |
| − | {{#set: molecular weight= | + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=30089 30089] |
| − | {{#set: common name= | + | * METABOLIGHTS : MTBLC30089 |
| − | {{#set: consumed by=RXN- | + | {{#set: smiles=CC([O-])=O}} |
| + | {{#set: inchi key=InChIKey=QTBSBXVTEAMEQO-UHFFFAOYSA-M}} | ||
| + | {{#set: common name=acetate}} | ||
| + | {{#set: molecular weight=59.044 }} | ||
| + | {{#set: common name=acetic acid|ethanoic acid}} | ||
| + | {{#set: consumed by=ACETATE--COA-LIGASE-RXN}} | ||
| + | {{#set: produced by=RXN66-3|RXN0-3962|RXN-12726|3.1.1.47-RXN}} | ||
| + | {{#set: reversible reaction associated=3.5.1.98-RXN|SULFOCYS-RXN|ACETYLORNDEACET-RXN|RXN-14728|ACSERLY-RXN|RXN-1744}} | ||
Revision as of 13:58, 21 March 2018
Contents
Metabolite ACET
- smiles:
- CC([O-])=O
- inchi key:
- InChIKey=QTBSBXVTEAMEQO-UHFFFAOYSA-M
- common name:
- acetate
- molecular weight:
- 59.044
- Synonym(s):
- acetic acid
- ethanoic acid
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CAS : 64-19-7
- CAS : 71-50-1
- BIGG : 33590
- DRUGBANK : DB03166
- PUBCHEM:
- HMDB : HMDB00042
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- METABOLIGHTS : MTBLC30089
"CC([O-])=O" cannot be used as a page name in this wiki.
