Difference between revisions of "CPD-787"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-787 CPD-787] == * smiles: ** C([O-])(=O)CC=CC=C(O)C(=O)[O-] * common name: ** (2Z,4Z)-2-hyd...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C([O-])(=O)CC=CC=C(O)C(=O)[O-] | ** C([O-])(=O)CC=CC=C(O)C(=O)[O-] | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 170.121 | ** 170.121 | ||
| + | * inchi key: | ||
| + | ** InChIKey=ZBCBETMBSDTINL-NWJCXACMSA-L | ||
| + | * common name: | ||
| + | ** (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate | ||
* Synonym(s): | * Synonym(s): | ||
** (2Z,4Z)-2-hydroxy-hept-2,4-diene-1,7-dioate | ** (2Z,4Z)-2-hydroxy-hept-2,4-diene-1,7-dioate | ||
| Line 19: | Line 19: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.11531600.html 11531600] | ** [http://www.chemspider.com/Chemical-Structure.11531600.html 11531600] | ||
| Line 27: | Line 25: | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C05600 C05600] | ** [http://www.genome.jp/dbget-bin/www_bget?C05600 C05600] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91828271 91828271] | ||
{{#set: smiles=C([O-])(=O)CC=CC=C(O)C(=O)[O-]}} | {{#set: smiles=C([O-])(=O)CC=CC=C(O)C(=O)[O-]}} | ||
| − | |||
| − | |||
{{#set: molecular weight=170.121 }} | {{#set: molecular weight=170.121 }} | ||
| + | {{#set: inchi key=InChIKey=ZBCBETMBSDTINL-NWJCXACMSA-L}} | ||
| + | {{#set: common name=(2Z,4Z)-2-hydroxyhepta-2,4-dienedioate}} | ||
{{#set: common name=(2Z,4Z)-2-hydroxy-hept-2,4-diene-1,7-dioate|HHDD|(2Z,4Z)-2-hydroxyhepta-2,4-diene-1,7-dioate}} | {{#set: common name=(2Z,4Z)-2-hydroxy-hept-2,4-diene-1,7-dioate|HHDD|(2Z,4Z)-2-hydroxyhepta-2,4-diene-1,7-dioate}} | ||
{{#set: consumed by=RXN1K-87}} | {{#set: consumed by=RXN1K-87}} | ||
Latest revision as of 13:12, 10 January 2019
Contents
Metabolite CPD-787
- smiles:
- C([O-])(=O)CC=CC=C(O)C(=O)[O-]
- molecular weight:
- 170.121
- inchi key:
- InChIKey=ZBCBETMBSDTINL-NWJCXACMSA-L
- common name:
- (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate
- Synonym(s):
- (2Z,4Z)-2-hydroxy-hept-2,4-diene-1,7-dioate
- HHDD
- (2Z,4Z)-2-hydroxyhepta-2,4-diene-1,7-dioate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"C([O-])(=O)CC=CC=C(O)C(=O)[O-" cannot be used as a page name in this wiki.
