Difference between revisions of "CPD-785"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-785 CPD-785] == * smiles: ** C(CC(C=CC(C([O-])=O)=O)C([O-])=O)([O-])=O * inchi key: ** InCh...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C(CC(C=CC(C([O-])=O)=O)C([O-])=O)([O-])=O | ** C(CC(C=CC(C([O-])=O)=O)C([O-])=O)([O-])=O | ||
| + | * molecular weight: | ||
| + | ** 213.123 | ||
* inchi key: | * inchi key: | ||
** InChIKey=WHGVLEMQINVDLH-QPHDTYRISA-K | ** InChIKey=WHGVLEMQINVDLH-QPHDTYRISA-K | ||
* common name: | * common name: | ||
** (3E,5R)-5-carboxy-2-oxohept-3-enedioate | ** (3E,5R)-5-carboxy-2-oxohept-3-enedioate | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** OPET | ** OPET | ||
| Line 21: | Line 21: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
| − | |||
| − | |||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87491 87491] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87491 87491] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91828236 91828236] | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C04052 C04052] | ** [http://www.genome.jp/dbget-bin/www_bget?C04052 C04052] | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.19951288.html 19951288] | ||
{{#set: smiles=C(CC(C=CC(C([O-])=O)=O)C([O-])=O)([O-])=O}} | {{#set: smiles=C(CC(C=CC(C([O-])=O)=O)C([O-])=O)([O-])=O}} | ||
| + | {{#set: molecular weight=213.123 }} | ||
{{#set: inchi key=InChIKey=WHGVLEMQINVDLH-QPHDTYRISA-K}} | {{#set: inchi key=InChIKey=WHGVLEMQINVDLH-QPHDTYRISA-K}} | ||
{{#set: common name=(3E,5R)-5-carboxy-2-oxohept-3-enedioate}} | {{#set: common name=(3E,5R)-5-carboxy-2-oxohept-3-enedioate}} | ||
| − | |||
{{#set: common name=OPET|5-carboxy-2-oxohex-3-ene-1,6-dioate|5-oxopent-3-ene-1,2,5-tricarboxylate|1-oxopent-3-ene-1,4,5-tricarboxylate}} | {{#set: common name=OPET|5-carboxy-2-oxohex-3-ene-1,6-dioate|5-oxopent-3-ene-1,2,5-tricarboxylate|1-oxopent-3-ene-1,4,5-tricarboxylate}} | ||
{{#set: consumed by=4.1.1.68-RXN|CARBOXY-OXOHEPT-ENEDIOATE-DECARBOXY-RXN}} | {{#set: consumed by=4.1.1.68-RXN|CARBOXY-OXOHEPT-ENEDIOATE-DECARBOXY-RXN}} | ||
Latest revision as of 17:28, 9 January 2019
Contents
Metabolite CPD-785
- smiles:
- C(CC(C=CC(C([O-])=O)=O)C([O-])=O)([O-])=O
- molecular weight:
- 213.123
- inchi key:
- InChIKey=WHGVLEMQINVDLH-QPHDTYRISA-K
- common name:
- (3E,5R)-5-carboxy-2-oxohept-3-enedioate
- Synonym(s):
- OPET
- 5-carboxy-2-oxohex-3-ene-1,6-dioate
- 5-oxopent-3-ene-1,2,5-tricarboxylate
- 1-oxopent-3-ene-1,4,5-tricarboxylate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"C(CC(C=CC(C([O-])=O)=O)C([O-])=O)([O-])=O" cannot be used as a page name in this wiki.
