CHEBI:129092 - [(2S,3R)-1-methylsulfonyl-3-phenyl-6-(2-pyridinylmethyl)-1,6-diazaspiro[3.3]heptan-2-yl]methanol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [(2S,3R)-1-methylsulfonyl-3-phenyl-6-(2-pyridinylmethyl)-1,6-diazaspiro[3.3]heptan-2-yl]methanol
ChEBI ID CHEBI:129092
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C19H23N3O3S
Net Charge 0
Average Mass 373.471
Monoisotopic Mass 373.14601
InChI InChI=1S/C19H23N3O3S/c1-26(24,25)22-17(12-23)18(15-7-3-2-4-8-15)19(22)13-21(14-19)11-16-9-5-6-10-20-16/h2-10,17-18,23H,11-14H2,1H3/t17-,18-/m1/s1
InChIKey CMLAFUFOGSEMCZ-QZTJIDSGSA-N
SMILES CS(=O)(=O)N1[C@@H]([C@H](C12CN(C2)CC3=CC=CC=N3)C4=CC=CC=C4)CO
ChEBI Ontology
Outgoing [(2S,3R)-1-methylsulfonyl-3-phenyl-6-(2-pyridinylmethyl)-1,6-diazaspiro[3.3]heptan-2-yl]methanol (CHEBI:129092) is a azetidines (CHEBI:38777)
[(2S,3R)-1-methylsulfonyl-3-phenyl-6-(2-pyridinylmethyl)-1,6-diazaspiro[3.3]heptan-2-yl]methanol (CHEBI:129092) is a benzenes (CHEBI:22712)
[(2S,3R)-1-methylsulfonyl-3-phenyl-6-(2-pyridinylmethyl)-1,6-diazaspiro[3.3]heptan-2-yl]methanol (CHEBI:129092) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-40643 LINCS
View more database links