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Zafirlukast metabolite M5

PropertiesImageOccurences in reactions
MNX_IDMNXM162192Image of MNXM162192
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC31H33N3O7S
charge0
mass591.20392
referencehmdb:HMDB0060986
InChIKeyHZAQOSFFIGVMDH-UHFFFAOYSA-N
InChIInChI=1S/C31H33N3O7S/c1-20-7-3-6-10-29(20)42(38,39)33-30(36)22-12-11-21(28(16-22)40-2)15-23-18-34(19-35)27-14-13-24(17-26(23)27)32-31(37)41-25-8-4-5-9-25/h3,6-7,10-14,16-18,25,35H,4-5,8-9,15,19H2,1-2H3,(H,32,37)(H,33,36)
SMILESCOc1cc(C(=O)NS(=O)(=O)c2ccccc2C)ccc1Cc1cn(CO)c2ccc(NC(=O)OC3CCCC3)cc12
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Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0060986 Zafirlukast metabolite M5
cyclopentyl N-[1-(hydroxymethyl)-3-({2-methoxy-4-[(2-methylbenzenesulfonyl)carbamoyl]phenyl}methyl)-1H-indol-5-yl]carbamate
cyclopentyl N-[1-(hydroxymethyl)-3-({2-methoxy-4-[(2-methylbenzenesulfonyl)carbamoyl]phenyl}methyl)indol-5-yl]carbamate
hmdb:HMDB60986 secondary/obsolete/fantasy identifier