CHEBI:130631 - (2S,3R)-2-(hydroxymethyl)-3-phenyl-N-propan-2-yl-1-(3,3,3-trifluoropropyl)-1,6-diazaspiro[3.3]heptane-6-carboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2S,3R)-2-(hydroxymethyl)-3-phenyl-N-propan-2-yl-1-(3,3,3-trifluoropropyl)-1,6-diazaspiro[3.3]heptane-6-carboxamide
ChEBI ID CHEBI:130631
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C19H26F3N3O2
Net Charge 0
Average Mass 385.425
Monoisotopic Mass 385.19771
InChI InChI=1S/C19H26F3N3O2/c1-13(2)23-17(27)24-11-18(12-24)16(14-6-4-3-5-7-14)15(10-26)25(18)9-8-19(20,21)22/h3-7,13,15-16,26H,8-12H2,1-2H3,(H,23,27)/t15-,16-/m1/s1
InChIKey YZAOSHCLUDBABW-HZPDHXFCSA-N
SMILES CC(C)NC(=O)N1CC2(C1)[C@@H]([C@H](N2CCC(F)(F)F)CO)C3=CC=CC=C3
ChEBI Ontology
Outgoing (2S,3R)-2-(hydroxymethyl)-3-phenyl-N-propan-2-yl-1-(3,3,3-trifluoropropyl)-1,6-diazaspiro[3.3]heptane-6-carboxamide (CHEBI:130631) is a azetidines (CHEBI:38777)
(2S,3R)-2-(hydroxymethyl)-3-phenyl-N-propan-2-yl-1-(3,3,3-trifluoropropyl)-1,6-diazaspiro[3.3]heptane-6-carboxamide (CHEBI:130631) is a benzenes (CHEBI:22712)
(2S,3R)-2-(hydroxymethyl)-3-phenyl-N-propan-2-yl-1-(3,3,3-trifluoropropyl)-1,6-diazaspiro[3.3]heptane-6-carboxamide (CHEBI:130631) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-42180 LINCS
View more database links