CHEBI:129242 - 1-[(2R,3R)-6-acetyl-2-(hydroxymethyl)-3-[4-(2-methylphenyl)phenyl]-1,6-diazaspiro[3.3]heptan-1-yl]-2-cyclopropylethanone

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 1-[(2R,3R)-6-acetyl-2-(hydroxymethyl)-3-[4-(2-methylphenyl)phenyl]-1,6-diazaspiro[3.3]heptan-1-yl]-2-cyclopropylethanone ChEBI ID CHEBI:129242 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C26H30N2O3 Net Charge 0 Average Mass 418.529 Monoisotopic Mass 418.22564 InChI InChI=1S/C26H30N2O3/c1-17-5-3-4-6-22(17)20-9-11-21(12-10-20)25-23(14-29)28(24(31)13-19-7-8-19)26(25)15-27(16-26)18(2)30/h3-6,9-12,19,23,25,29H,7-8,13-16H2,1-2H3/t23-,25+/m0/s1 InChIKey YFWUDGWAZBUJGR-UKILVPOCSA-N SMILES CC1=CC=CC=C1C2=CC=C(C=C2)[C@@H]3[C@@H](N(C34CN(C4)C(=O)C)C(=O)CC5CC5)CO ChEBI Ontology Outgoing 1-[(2R,3R)-6-acetyl-2-(hydroxymethyl)-3-[4-(2-methylphenyl)phenyl]-1,6-diazaspiro[3.3]heptan-1-yl]-2-cyclopropylethanone (CHEBI:129242) is a biphenyls (CHEBI:22888) Manual Xref Database LSM-40793 LINCS View more database links