CHEBI:126246 - LSM-37812

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-37812
ChEBI ID CHEBI:126246
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H32N2O2
Net Charge 0
Average Mass 356.503
Monoisotopic Mass 356.24638
InChI InChI=1S/C22H32N2O2/c1-4-6-16-9-11-17(12-10-16)21-19(23-20(21)14-25)13-24(15(2)3)22(26)18-7-5-8-18/h4,6,9-12,15,18-21,23,25H,5,7-8,13-14H2,1-3H3/t19-,20-,21+/m0/s1
InChIKey HPOHRDWPCZRFFC-PCCBWWKXSA-N
SMILES CC=CC1=CC=C(C=C1)[C@@H]2[C@@H](N[C@H]2CO)CN(C(C)C)C(=O)C3CCC3
ChEBI Ontology
Outgoing LSM-37812 (CHEBI:126246) is a azetidines (CHEBI:38777)
LSM-37812 (CHEBI:126246) is a benzenes (CHEBI:22712)
LSM-37812 (CHEBI:126246) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-37812 LINCS
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