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Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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1-phenyl-1H-1,2,4-triazole
Properties
Image
MNX_ID
MNXM32979
reference
chebi:38967
formula
C
8
H
7
N
3
global charge
0
mol weight
145.165
InChIKey
CGRLXLHYYDSTKR-UHFFFAOYSA-N
InChI
InChI=1S/C8H7N3/c1-2-4-8(5-3-1)11-7-9-6-10-11/h1-7H
SMILES
C1=CC=C(N2C=NC=N2)C=C1
MNX internals
InChI (mnx)
InChI=1/C8H7N3/c1-2-4-8(5-3-1)11-7-9-6-10-11/h1-7H
SMILES (mnx)
[CH:1]1=[CH:2][CH:4]=[C:8]([N:11]2[CH:7]=[N:9][CH:6]=[N:10]2)[CH:5]=[CH:3]1
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:38967
chebi:38967
CGRLXLHYYDSTKR-UHFFFAOYSA-N
1-phenyl-1H-1,2,4-triazole