Difference between revisions of "CPD-3766"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3766 CPD-3766] == * smiles: ** CC2(=CC(C1(C=CC=CC=1C2=O))=O) * common name: ** menadione *...") |
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* smiles: | * smiles: | ||
** CC2(=CC(C1(C=CC=CC=1C2=O))=O) | ** CC2(=CC(C1(C=CC=CC=1C2=O))=O) | ||
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| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 172.183 | ** 172.183 | ||
| + | * inchi key: | ||
| + | ** InChIKey=MJVAVZPDRWSRRC-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** menadione | ||
* Synonym(s): | * Synonym(s): | ||
** 2-methylnaphthoquinone | ** 2-methylnaphthoquinone | ||
| Line 20: | Line 20: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
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| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.3915.html 3915] | ** [http://www.chemspider.com/Chemical-Structure.3915.html 3915] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4055 4055] | ||
| + | * DRUGBANK : DB00170 | ||
| + | * REFMET : Menadione | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28869 28869] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28869 28869] | ||
| + | * CAS : 57414-02-5 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C05377 C05377] | ||
| + | * HMDB : HMDB01892 | ||
{{#set: smiles=CC2(=CC(C1(C=CC=CC=1C2=O))=O)}} | {{#set: smiles=CC2(=CC(C1(C=CC=CC=1C2=O))=O)}} | ||
| − | |||
| − | |||
{{#set: molecular weight=172.183 }} | {{#set: molecular weight=172.183 }} | ||
| + | {{#set: inchi key=InChIKey=MJVAVZPDRWSRRC-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=menadione}} | ||
{{#set: common name=2-methylnaphthoquinone|2-methyl-1,4-naphthalenedione|vitamin K3|2-methyl-1,4-naphthoquinone}} | {{#set: common name=2-methylnaphthoquinone|2-methyl-1,4-naphthalenedione|vitamin K3|2-methyl-1,4-naphthoquinone}} | ||
{{#set: consumed by=NADH-DEHYDROGENASE-QUINONE-RXN}} | {{#set: consumed by=NADH-DEHYDROGENASE-QUINONE-RXN}} | ||
Latest revision as of 15:38, 10 January 2019
Contents
Metabolite CPD-3766
- smiles:
- CC2(=CC(C1(C=CC=CC=1C2=O))=O)
- molecular weight:
- 172.183
- inchi key:
- InChIKey=MJVAVZPDRWSRRC-UHFFFAOYSA-N
- common name:
- menadione
- Synonym(s):
- 2-methylnaphthoquinone
- 2-methyl-1,4-naphthalenedione
- vitamin K3
- 2-methyl-1,4-naphthoquinone
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- DRUGBANK : DB00170
- REFMET : Menadione
- CHEBI:
- CAS : 57414-02-5
- LIGAND-CPD:
- HMDB : HMDB01892
