MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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The Swiss Initiative in Systems Biology
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senecioyl-pyrrothine
Properties
Image
Occurences in reactions
MNX_ID
MNXM161028
#reac
in my sandbox
0
in MNXref (generic)
0
in models (compartimentalized)
0
formula
C
11
H
12
N
2
O
2
S
2
charge
0
mass
268.03402
reference
metacycM:CPD-17963
InChIKey
JFEBCAJATWCFMT-UHFFFAOYSA-N
InChI
InChI=1S/C11H12N2O2S2/c1-6(2)4-8(14)12-9-10-7(5-16-17-10)13(3)11(9)15/h4-5H,1-3H3,(H,12,14)
SMILES
CC(C)=CC(=O)Nc1c2sscc-2n(C)c1=O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
metacyc.compound:CPD-17963
metacycM:CPD-17963
seed.compound:cpd31687
seedM:cpd31687
senecioyl-pyrrothine
seedM:M_cpd31687
secondary/obsolete/fantasy identifier