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Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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ChEBI
> Main
CHEBI:108060 - LSM-19437
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ChEBI Ontology
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ChEBI Name
LSM-19437
ChEBI ID
CHEBI:108060
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Molfile
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Formula
C21H17FN2O5S2
Net Charge
0
Average Mass
460.501
Monoisotopic Mass
460.05629
InChI
InChI=1S/C21H17FN2O5S2/c22-
8-
3-
1-
7(2-
4-
8)
12-
13-
9-
5-
10(16(13)
30-
18-
17(12)
31-
21(29)
23-
18)
15-
14(9)
19(27)
24(20(15)
28)
6-
11(25)
26/h1-
4,9-
10,12-
16H,5-
6H2,(H,23,29)
(H,25,26)
InChIKey
XPYPCAVHRVTFLO-UHFFFAOYSA-N
SMILES
C1C2C3C(C1C4C2C(=O)N(C4=O)CC(=O)O)SC5=C(C3C6=CC=C(C=C6)F)SC(=O)N5
ChEBI Ontology
Outgoing
LSM-19437 (
CHEBI:108060
)
is a
isoindoles (
CHEBI:24897
)
Manual Xref
Database
LSM-19437
LINCS
View more database links