CHEBI:127634 - [(2S,3S)-2-(hydroxymethyl)-1-(4-oxanylmethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-pyridin-4-ylmethanone

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ChEBI Name [(2S,3S)-2-(hydroxymethyl)-1-(4-oxanylmethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-pyridin-4-ylmethanone
ChEBI ID CHEBI:127634
Stars This entity has been manually annotated by a third party.
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Formula C24H29N3O3
Net Charge 0
Average Mass 407.506
Monoisotopic Mass 407.22089
InChI InChI=1S/C24H29N3O3/c28-15-21-22(19-4-2-1-3-5-19)24(27(21)14-18-8-12-30-13-9-18)16-26(17-24)23(29)20-6-10-25-11-7-20/h1-7,10-11,18,21-22,28H,8-9,12-17H2/t21-,22+/m1/s1
InChIKey WQHAYWAKIXADAJ-YADHBBJMSA-N
SMILES C1COCCC1CN2[C@@H]([C@@H](C23CN(C3)C(=O)C4=CC=NC=C4)C5=CC=CC=C5)CO
ChEBI Ontology
Outgoing [(2S,3S)-2-(hydroxymethyl)-1-(4-oxanylmethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-pyridin-4-ylmethanone (CHEBI:127634) is a azetidines (CHEBI:38777)
[(2S,3S)-2-(hydroxymethyl)-1-(4-oxanylmethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-pyridin-4-ylmethanone (CHEBI:127634) is a benzenes (CHEBI:22712)
[(2S,3S)-2-(hydroxymethyl)-1-(4-oxanylmethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-pyridin-4-ylmethanone (CHEBI:127634) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-39191 LINCS
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