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Examples:
iron*
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InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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ChEBI
> Main
CHEBI:108051 - LSM-19428
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ChEBI Ontology
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ChEBI Name
LSM-19428
ChEBI ID
CHEBI:108051
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C25H32N2O3
Net Charge
0
Average Mass
408.534
Monoisotopic Mass
408.24129
InChI
InChI=1S/C25H32N2O3/c1-
6-
30-
24(29)
21-
15(2)
26-
18-
13-
25(3,4)
14-
20(28)
23(18)
22(21)
17-
9-
10-
19-
16(12-
17)
8-
7-
11-
27(19)
5/h9-
10,12,21-
22H,6-
8,11,13-
14H2,1-
5H3
InChIKey
BGNIKVMFAFSPIL-UHFFFAOYSA-N
SMILES
CCOC(=O)C1C(C2=C(CC(CC2=O)(C)C)N=C1C)C3=CC4=C(C=C3)N(CCC4)C
ChEBI Ontology
Outgoing
LSM-19428 (
CHEBI:108051
)
is a
quinolines (
CHEBI:26513
)
Manual Xref
Database
LSM-19428
LINCS
View more database links