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albutoin

PropertiesImage
MNX_IDMNXM40551 Image of MNXM40551
referencechebi:134885
formulaC10H16N2OS
global charge0
mol weight212.318
InChIKeyRATGSRSDPNECNO-UHFFFAOYSA-N
InChIInChI=1S/C10H16N2OS/c1-4-5-12-9(13)8(6-7(2)3)11-10(12)14/h4,7-8H,1,5-6H2,2-3H3,(H,11,14)
SMILESC=CCN1C(=O)C(CC(C)C)NC1=S
MNX internals
InChI (mnx)InChI=1/C10H16N2OS/c1-4-5-12-9(13)8(6-7(2)3)11-10(12)14/h4,7-8H,1,5-6H2,2-3H3,(H,11,14)/t8? Image of MNXM40551
SMILES (mnx)[CH2:1]=[CH:4][CH2:5][N:12]1[C:9](=[O:13])[CH:8]([CH2:6][CH:7]([CH3:2])[CH3:3])[N:11]=[C:10]1[SH:14]
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:134885
chebi:134885
RATGSRSDPNECNO-UHFFFAOYSA-N 		albutoin
euprax

kegg.drug:D02797
keggD:D02797
RATGSRSDPNECNO-UHFFFAOYSA-N 		Albutoin (USAN/INN)
Euprax (TN)

keggD:M_D02797 		secondary/obsolete/fantasy identifier