Difference between revisions of "BUTANOL"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BUTANOL BUTANOL] == * smiles: ** CCCCO * common name: ** butan-1-ol * inchi key: ** InChIKey=LR...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CCCCO | ** CCCCO | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 74.122 | ** 74.122 | ||
| + | * inchi key: | ||
| + | ** InChIKey=LRHPLDYGYMQRHN-UHFFFAOYSA-N | ||
| + | * common name: | ||
| + | ** butan-1-ol | ||
* Synonym(s): | * Synonym(s): | ||
** n-butyl alcohol | ** n-butyl alcohol | ||
| Line 21: | Line 21: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
* [[RXN-161]] | * [[RXN-161]] | ||
| − | |||
== External links == | == External links == | ||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.258.html 258] | ** [http://www.chemspider.com/Chemical-Structure.258.html 258] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=263 263] | ||
| + | * DRUGBANK : DB02145 | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28885 28885] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28885 28885] | ||
| + | * CAS : 71-36-3 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C06142 C06142] | ||
| + | * HMDB : HMDB04327 | ||
* METABOLIGHTS : MTBLC28885 | * METABOLIGHTS : MTBLC28885 | ||
{{#set: smiles=CCCCO}} | {{#set: smiles=CCCCO}} | ||
| − | |||
| − | |||
{{#set: molecular weight=74.122 }} | {{#set: molecular weight=74.122 }} | ||
| + | {{#set: inchi key=InChIKey=LRHPLDYGYMQRHN-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=butan-1-ol}} | ||
{{#set: common name=n-butyl alcohol|n-butanol|butanol|1-hydroxybutane|1-butanol}} | {{#set: common name=n-butyl alcohol|n-butanol|butanol|1-hydroxybutane|1-butanol}} | ||
{{#set: produced by=BTS_LPAREN_nadph_RPAREN_}} | {{#set: produced by=BTS_LPAREN_nadph_RPAREN_}} | ||
| − | {{#set: reversible reaction associated=RXN-161 | + | {{#set: reversible reaction associated=RXN-161}} |
Latest revision as of 12:23, 10 January 2019
Contents
Metabolite BUTANOL
- smiles:
- CCCCO
- molecular weight:
- 74.122
- inchi key:
- InChIKey=LRHPLDYGYMQRHN-UHFFFAOYSA-N
- common name:
- butan-1-ol
- Synonym(s):
- n-butyl alcohol
- n-butanol
- butanol
- 1-hydroxybutane
- 1-butanol
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- DRUGBANK : DB02145
- CHEBI:
- CAS : 71-36-3
- LIGAND-CPD:
- HMDB : HMDB04327
- METABOLIGHTS : MTBLC28885
