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Substance
ID:1822464
Structure
Similarity
Functional Group
Text
ID:1905
butan-1-ol
Chemical Entities of Biological Interest
ID: CHEBI:28885
Names and Identifiers
IUPAC name
butan-1-ol
IUPAC Traditional name
butanol
Synonyms
butan-1-ol
1-BUTANOL
1-Butanol
1-butyl alcohol
1-hydroxybutane
BuOH
butan-1-ol
n-Butanol
n-Butylalkohol
n-butan-1-ol
n-butyl alcohol
propyl carbinol
Registration numbers
CAS Number
71-36-3
Beilstein Number
969148
PubChem CID
263
Gmelin ID
25753
DrugBank ID
DB02145
Wikipedia Title
N-Butanol
KEGG ID
C06142
MetaCyc Database
BUTANOL
PubMed Citation Links
7096503
23980702
Reaxys Registry
969148
ACToR Database
107569-51-7
35296-72-1
71-36-3
BKMS React Database
218114
BRENDA Database
3.2.1.1
3.2.1.126
3.2.1.31
4.6.1.1
3.1.1.20
3.1.1.7
3.1.3.8
3.1.1.13
3.1.4.4
3.2.1.37
3.1.1.1
3.2.1.8
3.5.1.24
3.5.1.9
1.14.15.3
1.1.1.49
3.2.1.21
3.2.1.4
1.13.11.27
1.14.99.14
1.13.11.3
2.4.1.19
2.7.1.30
3.1.4.50
4.6.1.14
3.2.1.B26
3.2.1.B34
4.2.1.9
3.4.21.63
3.4.24.23
3.4.24.27
3.4.24.30
3.4.24.72
4.1.2.13
4.2.1.98
3.4.21.10
3.1.1.3
3.4.11.10
3.1.1.5
3.1.3.1
3.1.7.1
3.4.11.1
3.4.19.3
3.4.21.25
3.1.3.2
3.1.4.12
3.2.1.38
3.2.1.23
3.1.1.74
3.2.1.2
3.2.1.78
3.5.1.36
3.5.1.4
3.5.5.1
3.6.1.27
1.1.3.40
1.1.3.6
1.17.1.9
1.2.1.46
1.2.1.3
3.2.1.14
1.7.1.10
1.14.12.7
1.13.11.2
1.11.1.7
2.3.1.26
2.4.1.15
2.4.1.39
1.1.1.6
2.5.1.49
2.5.1.18
1.1.1.47
2.7.1.66
2.7.8.2
3.1.1.67
3.2.1.116
4.3.1.24
3.2.1.B1
2.7.1.165
4.1.2.47
5.4.99.30
1.1.99.36
4.2.1.150
3.2.1.207
3.1.1.108
3.1.1.118
1.1.1.1
1.1.1.80
1.2.98.1
1.1.1.2
1.1.1.244
1.1.2.7
1.1.9.1
1.1.2.B3
1.1.1.B4
1.1.5.11
1.1.3.13
2.8.2.2
1.2.5.2
1.1.2.9
1.1.2.10
1.1.5.5
1.1.1.195
1.1.1.54
1.1.1.71
1.1.1.192
1.1.1.21
1.1.1.306
2.3.1.84
1.1.2.B2
1.1.1.103
1.14.13.230
1.1.1.202
1.1.2.8
3.1.1.72
3.1.1.43
3.1.1.50
3.1.1.8
3.5.1.75
1.1.1.265
3.5.99.1
3.8.1.5
1.1.1.191
1.1.1.72
1.1.1.188
3.5.1.3
1.1.1.184
1.14.13.25
1.14.13.22
3.1.1.2
3.1.1.47
3.1.1.73
1.14.18.3
3.1.1.85
1.1.1.219
3.1.1.60
3.2.1.94
3.2.1.22
1.1.1.73
1.1.1.245
1.1.99.12
1.1.1.284
1.1.3.18
1.1.1.91
2.4.1.35
3.2.1.97
3.2.1.52
2.3.1.75
1.1.1.76
3.4.21.62
2.4.1.5
1.1.1.183
2.8.2.22
1.1.1.105
5.4.99.17
BRENDA Ligand Database
218114
CHEMBL
CHEMBL14245
CompTox Database
DTXSID1021740
MetaboLights Database
MTBLS760
MTBLS682
MTBLS1391
MTBLS298
MTBLS4099
MTBLS392
MTBLS212
Protein Data Bank
1g4h
1okx
1ooh
1yky
2huf
2huu
2vdg
3b6x
3et2
3s3e
3s3f
3s3h
5el1
5emu
5med
5z3s
7nrj
7o1z
7o5n
7o5q
SABIO-RK Database
14241
14685
14686
7325
3328
16144
3329
10563
9969
11866
15619
15960
SureChEMBL Database
SCHEMBL532
UniProt Database
Q9ZNN8
Q4W6G0
Q8GR64
P80175
P81747
Q52078
Q54WR4
Q54Z25
Q54K50
Q54SA1
Q54UK0
IntEnz Database
EC 1.1.2.9
EC 1.1.5.11
EC 1.14.13.230
Rhea Database
RHEA:64676
RHEA:64632
RHEA:65404
RHEA:50000
RHEA:33199
RHEA:64644
RHEA:43432
RHEA:65400
RHEA:64636
RHEA:64672
RHEA:49808
RHEA:64708
HMDB Database
HMDB0004327
PDBeChem Database
1BO
PPDB Database
1,309
NMRShiftDB Database
10016622
Patent number
US2003153031
US2004063980
US2005085545
US2005250828
US2006004067
US2006194869
US2006270711
US2007105201
WO2005003104
WO2005018643
WO2005023806
WO2005037821
WO2005058819
WO2005089353
WO2006001846
WO2006035433
WO2006048890
WO2006075244
WO2006137773
WO2008108742
WO2008127618
WO2008149204
EP1760077
GB1464774
US2005085652
US2005187243
US2005250706
US2008020956
WO2005115981
WO2006057972
WO2006106531
EP0775703
EP0853078
EP0962438
EP1074548
EP1162202
EP1191023
EP1318200
EP1550659
EP1741711
EP1857454
EP1950215
US2003171597
US2004106813
US2004116526
US2004204617
US2004235951
US2005124629
US2005153954
US2005154057
US2005277651
US2006004230
US2006094774
US2006135548
US2006183738
US2006270685
WO2005021549
WO2005035531
WO2005067922
WO2005090359
WO2006008636
WO2006020664
WO2006030452
WO2006069386
WO2006099452
WO2008117298
WO2008151584
EP1209148
EP1213280
EP1321462
EP1352687
EP1647268
EP1726591
EP1894927
US2004019211
US2005038120
US2005038271
US2005070551
US2005107359
US2005192337
US2005272675
US2006020137
US2006122227
US2008249149
WO2005058835
WO2005121124
WO2006037125
WO2006070275
WO2006090270
WO2006117300
WO2008135980
WO2008156780
US2005032884
WO2006079504
EP0815857
EP0856515
EP0905130
EP1132373
EP1147764
EP1166643
EP1359149
EP1394144
EP1666476
EP1818336
EnzymePortal Database
Q4W6G0
Q8GR64
Q54SA1
Q54UK0
Q54WR4
Q54Z25
Q54K50
GeneOntology Database
GO:0071271
GO:1901422
GO:1902700
GO:1902703
GO:0010123
GO:0071270
BindingDB Database
36173
KEGG DRUG Database
D03200
CHEBI ID
CHEBI:28885
CHEBI:39632
CHEBI:22936
CHEBI:612
PubChem SID
8144259
Properties
No Data Available
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Molecule Details
A primary alcohol that is butane in which a hydrogen of one of the methyl groups is substituted by a hydroxy group. It it produced in small amounts in humans by the gut microbes.
Molecular Spectra
No Data Available
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References
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