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1-[(2R,3R)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-1-oxoethyl]-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-1-propanone

PropertiesImage
MNX_IDMNXM339038 Image of MNXM339038
referencechebi:126381
formulaC21H29N3O4
global charge0
mol weight387.48
InChIKeyBPUIWZWXAYCJKI-FXAWDEMLSA-N
InChIInChI=1S/C21H29N3O4/c1-2-18(26)24-17(13-25)20(16-6-4-3-5-7-16)21(24)14-23(15-21)19(27)12-22-8-10-28-11-9-22/h3-7,17,20,25H,2,8-15H2,1H3/t17-,20+/m0/s1
SMILESCCC(=O)N1[C@@H](CO)[C@@H](C2=CC=CC=C2)C12CN(C(=O)CN1CCOCC1)C2
MNX internals
InChI (mnx)InChI=1/C21H29N3O4/c1-2-18(26)24-17(13-25)20(16-6-4-3-5-7-16)21(24)14-23(15-21)19(27)12-22-8-10-28-11-9-22/h3-7,17,20,25H,2,8-15H2,1H3/t17-,20+/m0/s1 Image of MNXM339038
SMILES (mnx)[CH3:1][CH2:2][C:18]([N:24]1[C@@H:17]([CH2:13][OH:25])[C@@H:20]([C:16]2=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]2)[C:21]12[CH2:14][N:23]([C:19]([CH2:12][N:22]1[CH2:8][CH2:10][O:28][CH2:11][CH2:9]1)=[O:27])[CH2:15]2)=[O:26]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:126381
chebi:126381
BPUIWZWXAYCJKI-FXAWDEMLSA-N
1-[(2R,3R)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-1-oxoethyl]-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-1-propanone