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ChEBI
> Main
CHEBI:48945 - 2-methylbutan-1-ol
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ChEBI Ontology
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ChEBI Name
2-methylbutan-1-ol
ChEBI ID
CHEBI:48945
Definition
A primary alcohol that is isopentane substituted by a hydroxy group at position 1.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C5H12O
Net Charge
0
Average Mass
88.14818
Monoisotopic Mass
88.08882
InChI
InChI=1S/C5H12O/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3
InChIKey
QPRQEDXDYOZYLA-UHFFFAOYSA-N
SMILES
CCC(C)CO
Metabolite of Species
Details
Saccharomyces cerevisiae
(NCBI:txid4932)
Source: yeast.sf.net See:
PubMed
Roles Classification
Biological Role
(s):
Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (
Saccharomyces cerevisiae
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-methylbutan-1-ol (
CHEBI:48945
)
has parent hydride
isopentane (
CHEBI:30362
)
2-methylbutan-1-ol (
CHEBI:48945
)
has role
Saccharomyces cerevisiae
metabolite (
CHEBI:75772
)
2-methylbutan-1-ol (
CHEBI:48945
)
is a
alkyl alcohol (
CHEBI:50584
)
2-methylbutan-1-ol (
CHEBI:48945
)
is a
primary alcohol (
CHEBI:15734
)
Incoming
2-methylbutyl acetate (
CHEBI:50585
)
has functional parent
2-methylbutan-1-ol (
CHEBI:48945
)
2-methylbutyl butanoate (
CHEBI:156490
)
has functional parent
2-methylbutan-1-ol (
CHEBI:48945
)
2-methylbutyl decanoate (
CHEBI:87330
)
has functional parent
2-methylbutan-1-ol (
CHEBI:48945
)
2-methylbutyl hexanoate (
CHEBI:156542
)
has functional parent
2-methylbutan-1-ol (
CHEBI:48945
)
(
R
)-2-methylbutan-1-ol (
CHEBI:50624
)
is a
2-methylbutan-1-ol (
CHEBI:48945
)
(
S
)-2-methylbutan-1-ol (
CHEBI:50625
)
is a
2-methylbutan-1-ol (
CHEBI:48945
)
IUPAC Name
2-methylbutan-1-ol
Synonyms
Sources
2-methyl butanol-1
ChemIDplus
2-methyl-1-butanol
ChemIDplus
2-methyl-
n
-butanol
ChemIDplus
2-methylbutan-1-ol
UniProt
2-methylbutanol
NIST Chemistry WebBook
2-methylbutyl alcohol
ChemIDplus
active amyl alcohol
NIST Chemistry WebBook
active primary amyl alcohol
ChemIDplus
CH
3
CH
2
CH(CH
3
)CH
2
OH
NIST Chemistry WebBook
methyl-2-butan-1-ol
NIST Chemistry WebBook
primary active amyl alcohol
ChemIDplus
sec
-butylcarbinol
ChemIDplus
Manual Xrefs
Databases
CPD-7033
MetaCyc
HMDB0031527
HMDB
View more database links
Registry Numbers
Types
Sources
137-32-6
CAS Registry Number
ChemIDplus
137-32-6
CAS Registry Number
NIST Chemistry WebBook
1718810
Reaxys Registry Number
Reaxys
600874
Gmelin Registry Number
Gmelin
Citations
Types
Sources
20812374
PubMed citation
Europe PMC
22821412
PubMed citation
Europe PMC
Last Modified
10 September 2020