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Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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ChEBI
> Main
CHEBI:107098 - LSM-18452
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ChEBI Ontology
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ChEBI Name
LSM-18452
ChEBI ID
CHEBI:107098
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C21H17FN4O3S
Net Charge
0
Average Mass
424.450
Monoisotopic Mass
424.10054
InChI
InChI=1S/C21H17FN4O3S/c1-
29-
16-
5-
3-
2-
4-
14(16)
23-
17(27)
11-
26-
15-
7-
6-
12(22)
10-
13(15)
18-
19(26)
20(28)
25-
8-
9-
30-
21(25)
24-
18/h2-
7,10H,8-
9,11H2,1H3,(H,23,27)
InChIKey
MJIKQZYDJKDBGN-UHFFFAOYSA-N
SMILES
COC1=CC=CC=C1NC(=O)CN2C3=C(C=C(C=C3)F)C4=C2C(=O)N5CCSC5=N4
ChEBI Ontology
Outgoing
LSM-18452 (
CHEBI:107098
)
is a
indoles (
CHEBI:24828
)
Manual Xref
Database
LSM-18452
LINCS
View more database links