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oxeladin

PropertiesImage
MNX_IDMNXM128928 Image of MNXM128928
referencechebi:135424
formulaC20H33NO3
global charge0
mol weight335.488
InChIKeyIQADUMSPOQKAAO-UHFFFAOYSA-N
InChIInChI=1S/C20H33NO3/c1-5-20(6-2,18-12-10-9-11-13-18)19(22)24-17-16-23-15-14-21(7-3)8-4/h9-13H,5-8,14-17H2,1-4H3
SMILESCCN(CC)CCOCCOC(=O)C(CC)(CC)C1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C20H33NO3/c1-5-20(6-2,18-12-10-9-11-13-18)19(22)24-17-16-23-15-14-21(7-3)8-4/h9-13H,5-8,14-17H2,1-4H3 Image of MNXM128928
SMILES (mnx)[CH3:1][CH2:5][C:20]([CH2:6][CH3:2])([C:18]1=[CH:12][CH:10]=[CH:9][CH:11]=[CH:13]1)[C:19](=[O:22])[O:24][CH2:17][CH2:16][O:23][CH2:15][CH2:14][N:21]([CH2:7][CH3:3])[CH2:8][CH3:4]
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:135424
chebi:135424
IQADUMSPOQKAAO-UHFFFAOYSA-N 		oxeladin
oxeladin citrate

kegg.drug:D08310
keggD:D08310
IQADUMSPOQKAAO-UHFFFAOYSA-N 		Oxeladin (INN)

keggD:M_D08310 		secondary/obsolete/fantasy identifier