CHEBI:127978 - LSM-39534

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ChEBI Name LSM-39534
ChEBI ID CHEBI:127978
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C19H26N2O2
Net Charge 0
Average Mass 314.423
Monoisotopic Mass 314.19943
InChI InChI=1S/C19H26N2O2/c1-2-3-13-6-8-15(9-7-13)19-16(21-17(19)12-22)11-20-18(23)10-14-4-5-14/h2-3,6-9,14,16-17,19,21-22H,4-5,10-12H2,1H3,(H,20,23)/t16-,17-,19-/m1/s1
InChIKey DEPAKNUSPISUKF-ZHALLVOQSA-N
SMILES CC=CC1=CC=C(C=C1)[C@@H]2[C@H](N[C@@H]2CO)CNC(=O)CC3CC3
ChEBI Ontology
Outgoing LSM-39534 (CHEBI:127978) is a azetidines (CHEBI:38777)
LSM-39534 (CHEBI:127978) is a benzenes (CHEBI:22712)
LSM-39534 (CHEBI:127978) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-39534 LINCS
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