Difference between revisions of "CPD-182"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=NIACINAMIDE NIACINAMIDE] == * smiles: ** C1(N=CC(C(=O)N)=CC=1) * inchi key: ** InChIKey=DFPAKSU...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-182 CPD-182] == * smiles: ** CC1(=CC(OC2(C=C(O)C=CC1=2))=O) * inchi key: ** InChIKey=HSHNIT...") |
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[[Category:Metabolite]] | [[Category:Metabolite]] | ||
| − | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object= | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-182 CPD-182] == |
* smiles: | * smiles: | ||
| − | ** | + | ** CC1(=CC(OC2(C=C(O)C=CC1=2))=O) |
* inchi key: | * inchi key: | ||
| − | ** InChIKey= | + | ** InChIKey=HSHNITRMYYLLCV-UHFFFAOYSA-N |
* common name: | * common name: | ||
| − | ** | + | ** 4-methylumbelliferone |
* molecular weight: | * molecular weight: | ||
| − | ** | + | ** 176.171 |
* Synonym(s): | * Synonym(s): | ||
| − | ** | + | ** Hymecromone |
| − | + | ||
| − | + | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
| − | * [[ | + | * [[RXN-10769]] |
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| − | |||
== External links == | == External links == | ||
| − | * CAS : | + | * CAS : 90-33-5 |
| − | + | * DRUGBANK : DB07118 | |
| − | * DRUGBANK : | + | |
* PUBCHEM: | * PUBCHEM: | ||
| − | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid= | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280567 5280567] |
| − | + | * HMDB : HMDB59622 | |
| − | * HMDB : | + | |
* LIGAND-CPD: | * LIGAND-CPD: | ||
| − | ** [http://www.genome.jp/dbget-bin/www_bget? | + | ** [http://www.genome.jp/dbget-bin/www_bget?C03081 C03081] |
* CHEMSPIDER: | * CHEMSPIDER: | ||
| − | ** [http://www.chemspider.com/Chemical-Structure. | + | ** [http://www.chemspider.com/Chemical-Structure.4444190.html 4444190] |
* CHEBI: | * CHEBI: | ||
| − | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId= | + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17224 17224] |
| − | * METABOLIGHTS : | + | * METABOLIGHTS : MTBLC17224 |
| − | {{#set: smiles= | + | {{#set: smiles=CC1(=CC(OC2(C=C(O)C=CC1=2))=O)}} |
| − | {{#set: inchi key=InChIKey= | + | {{#set: inchi key=InChIKey=HSHNITRMYYLLCV-UHFFFAOYSA-N}} |
| − | {{#set: common name= | + | {{#set: common name=4-methylumbelliferone}} |
| − | {{#set: molecular weight= | + | {{#set: molecular weight=176.171 }} |
| − | {{#set: common name= | + | {{#set: common name=Hymecromone}} |
| − | {{#set: produced by= | + | {{#set: produced by=RXN-10769}} |
| − | + | ||
Latest revision as of 20:54, 21 March 2018
Contents
Metabolite CPD-182
- smiles:
- CC1(=CC(OC2(C=C(O)C=CC1=2))=O)
- inchi key:
- InChIKey=HSHNITRMYYLLCV-UHFFFAOYSA-N
- common name:
- 4-methylumbelliferone
- molecular weight:
- 176.171
- Synonym(s):
- Hymecromone
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CAS : 90-33-5
- DRUGBANK : DB07118
- PUBCHEM:
- HMDB : HMDB59622
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- METABOLIGHTS : MTBLC17224
