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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:101405 - LSM-12768
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ChEBI Ontology
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ChEBI Name
LSM-12768
ChEBI ID
CHEBI:101405
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Molfile
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Formula
C23H27N3O3
Net Charge
0
Average Mass
393.480
Monoisotopic Mass
393.20524
InChI
InChI=1S/C23H27N3O3/c27-
14-
17-
18-
13-
26-
19(10-
9-
16(22(26)
28)
15-
7-
3-
1-
4-
8-
15)
21(24-
18)
20(17)
23(29)
25-
11-
5-
2-
6-
12-
25/h1,3-
4,7-
10,17-
18,20-
21,24,27H,2,5-
6,11-
14H2/t17-
,18-
,20+,21+/m1/s1
InChIKey
JIIRQJXSNNBKIS-QCFAMHMHSA-N
SMILES
C1CCN(CC1)C(=O)[C@H]2[C@@H]([C@H]3CN4C(=CC=C(C4=O)C5=CC=CC=C5)[C@@H]2N3)CO
ChEBI Ontology
Outgoing
LSM-12768 (
CHEBI:101405
)
is a
phenylpyridine (
CHEBI:38193
)
Manual Xref
Database
LSM-12768
LINCS
View more database links