The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Id http://purl.obolibrary.org/obo/CHEBI_41189
http://purl.obolibrary.org/obo/CHEBI_41189
Preferred Name

butane-1,4-diol
Synonyms
HOCH2CH2CH2CH2OH
tetramethylene 1,4-diol
HO(CH2)4OH
1,4-BD
1,4-butylene glycol
tetramethylene glycol
1,4-tetramethylene glycol
butane-1,4-diol
C4H10O2
1,4-dihydroxybutane
1,4-BUTANEDIOL
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Type http://www.w3.org/2002/07/owl#Class

All Properties

prefLabel
butane-1,4-diol
label
butane-1,4-diol
Definition
A butanediol that is butane in which one hydrogen of each of the methyl groups is substituted by a hydroxy group. A colourless, water-miscible, viscous liquid at room temperature (m.p. 16degreeC) with a high boiling point (230degreeC), it is mainly used for the production of other organic chemicals, particularly the solvent oxolane (also known as tetrahydrofuran or THF).
type
has role
InChIKey
InChIKey=WERYXYBDKMZEQL-UHFFFAOYSA-N
Synonym
HOCH2CH2CH2CH2OH
tetramethylene 1,4-diol
HO(CH2)4OH
1,4-BD
1,4-butylene glycol
tetramethylene glycol
1,4-tetramethylene glycol
butane-1,4-diol
C4H10O2
1,4-dihydroxybutane
1,4-BUTANEDIOL
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xref
CiteXplore:15298490
CiteXplore:20112336
CiteXplore:11803699
CiteXplore:21548140
CiteXplore:19915428
ChEBI:41189
Drugs Product Database (DPD):2248224
Wikipedia:1,4-Butanediol
PDB:BU1
PubChem Substance:46506248
CiteXplore:16193534
DrugBank:DB01955
Wikipedia:http://en.wikipedia.org/wiki/1,4-Butanediol
CiteXplore:21602812
NIST Chemistry WebBook:110-63-4
CiteXplore:18203723
ChEMBL:384185
PDBeChem:BU1
Reaxys:1633445
CiteXplore:17854202
ChemSpider:13835209
CASRN:110-63-4
PubChem Compound:8064
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CASRN
110-63-4
prefixIRI
obo2:CHEBI_41189
related with
SMILES
OCCCCO
DBname
1,4-butanediol
InChI
InChI=1S/C4H10O2/c5-3-1-2-4-6/h5-6H,1-4H2
subClassOf
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