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Examples:
iron*
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InChI=1S/CH4O/c1-2/h2H,1H3
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caffeine
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ChEBI
> Main
CHEBI:129630 - LSM-41181
Main
ChEBI Ontology
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ChEBI Name
LSM-41181
ChEBI ID
CHEBI:129630
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C19H26N2O4S
Net Charge
0
Average Mass
378.488
Monoisotopic Mass
378.16133
InChI
InChI=1S/C19H26N2O4S/c1-
4-
6-
14-
7-
9-
15(10-
8-
14)
18-
16(11-
22)
21(26(3,24)
25)
19(18)
12-
20(13-
19)
17(23)
5-
2/h4,6-
10,16,18,22H,5,11-
13H2,1-
3H3/t16-
,18-
/m1/s1
InChIKey
XJAHBTLOJHBYDS-SJLPKXTDSA-N
SMILES
CCC(=O)N1CC2(C1)[C@@H]([C@H](N2S(=O)(=O)C)CO)C3=CC=C(C=C3)C=CC
ChEBI Ontology
Outgoing
LSM-41181 (
CHEBI:129630
)
is a
azetidines (
CHEBI:38777
)
LSM-41181 (
CHEBI:129630
)
is a
benzenes (
CHEBI:22712
)
LSM-41181 (
CHEBI:129630
)
is a
ring assembly (
CHEBI:36820
)
Manual Xref
Database
LSM-41181
LINCS
View more database links