MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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but-1-yne
Properties
Image
MNX_ID
MNXM44941
reference
chebi:48087
formula
C
4
H
6
global charge
0
mol weight
54.092
InChIKey
KDKYADYSIPSCCQ-UHFFFAOYSA-N
InChI
InChI=1S/C4H6/c1-3-4-2/h1H,4H2,2H3
SMILES
C#CCC
MNX internals
InChI (mnx)
InChI=1/C4H6/c1-3-4-2/h1H,4H2,2H3
SMILES (mnx)
[CH:1]#[C:3][CH2:4][CH3:2]
Parent-child relations graph
Occurences in reactions
#reac
in my sandbox
0
in MNXref (generic)
0
in models (compartimentalized)
0
Similar chemical compounds in external resources
Identifier
Description
CHEBI:48087
chebi:48087
KDKYADYSIPSCCQ-UHFFFAOYSA-N
but-1-yne
1-butyne
ethyl acetylene
ethylacetylene