Difference between revisions of "CPD-7035"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CHOLINE CHOLINE] == * smiles: ** C(CO)[N+](C)(C)C * inchi key: ** InChIKey=OEYIOHPDSNJKLS-UHFFF...") |
|||
| (3 intermediate revisions by the same user not shown) | |||
| Line 1: | Line 1: | ||
[[Category:Metabolite]] | [[Category:Metabolite]] | ||
| − | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object= | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7035 CPD-7035] == |
* smiles: | * smiles: | ||
| − | ** C( | + | ** C1(C=CC(CCO)=CC=1) |
| + | * molecular weight: | ||
| + | ** 122.166 | ||
* inchi key: | * inchi key: | ||
| − | ** InChIKey= | + | ** InChIKey=WRMNZCZEMHIOCP-UHFFFAOYSA-N |
* common name: | * common name: | ||
| − | ** | + | ** 2-phenylethanol |
| − | + | ||
| − | + | ||
* Synonym(s): | * Synonym(s): | ||
| − | ** | + | ** benzeneethanol |
| + | ** phenethanol | ||
== 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-7700]] | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| − | |||
== External links == | == External links == | ||
| − | + | * METABOLIGHTS : MTBLC49000 | |
| − | + | ||
| − | + | ||
| − | * METABOLIGHTS : | + | |
| − | + | ||
| − | + | ||
| − | + | ||
| − | + | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
| − | ** [http://www.genome.jp/dbget-bin/www_bget? | + | ** [http://www.genome.jp/dbget-bin/www_bget?C05853 C05853] |
| + | * HMDB : HMDB33944 | ||
* CHEMSPIDER: | * CHEMSPIDER: | ||
| − | ** [http://www.chemspider.com/Chemical-Structure. | + | ** [http://www.chemspider.com/Chemical-Structure.5830.html 5830] |
* CHEBI: | * CHEBI: | ||
| − | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId= | + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=49000 49000] |
| − | * | + | * DRUGBANK : DB02192 |
| − | {{#set: smiles= | + | * PUBCHEM: |
| − | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6054 6054] | |
| − | {{#set: | + | {{#set: smiles=C1(C=CC(CCO)=CC=1)}} |
| − | {{#set: | + | {{#set: molecular weight=122.166 }} |
| − | {{#set: common name= | + | {{#set: inchi key=InChIKey=WRMNZCZEMHIOCP-UHFFFAOYSA-N}} |
| − | {{#set: | + | {{#set: common name=2-phenylethanol}} |
| − | {{#set: | + | {{#set: common name=benzeneethanol|phenethanol}} |
| + | {{#set: produced by=RXN-7700}} | ||
Latest revision as of 16:27, 9 January 2019
Contents
Metabolite CPD-7035
- smiles:
- C1(C=CC(CCO)=CC=1)
- molecular weight:
- 122.166
- inchi key:
- InChIKey=WRMNZCZEMHIOCP-UHFFFAOYSA-N
- common name:
- 2-phenylethanol
- Synonym(s):
- benzeneethanol
- phenethanol
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- METABOLIGHTS : MTBLC49000
- LIGAND-CPD:
- HMDB : HMDB33944
- CHEMSPIDER:
- CHEBI:
- DRUGBANK : DB02192
- PUBCHEM:
