CHEBI:129630 - LSM-41181

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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
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