N-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxybenzyl]thiocarbamic acid O-isobutyl ester

SpectraBase Compound ID	I83HDEB7K3v
InChI	InChI=1S/C18H27NO6S/c1-10(2)9-23-18(26)19-8-12-4-6-13(7-5-12)25-17-16(22)15(21)14(20)11(3)24-17/h4-7,10-11,14-17,20-22H,8-9H2,1-3H3,(H,19,26)/t11-,14-,15+,16+,17-/m0/s1
InChIKey	KYZLRYHVPYVKJF-VGVPKUIYSA-N Google Search
Mol Weight	385.48 g/mol
Molecular Formula	C18H27NO6S
Exact Mass	385.155909 g/mol

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SpectraBase Spectrum ID	HD6HqL3iEwl
Name	N-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxybenzyl]thiocarbamic acid O-isobutyl ester
Alternate Name(s)	N-[[4-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]phenyl]methyl]carbamothioic acid O-(2-methylpropyl) ester O-(2-methylpropyl) N-[[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methyl]carbamothioate O-(2-methylpropyl) N-[[4-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]methyl]carbamothioate O-isobutyl N-[[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxyphenyl]methyl]carbamothioate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H27NO6S
InChI	InChI=1S/C18H27NO6S/c1-10(2)9-23-18(26)19-8-12-4-6-13(7-5-12)25-17-16(22)15(21)14(20)11(3)24-17/h4-7,10-11,14-17,20-22H,8-9H2,1-3H3,(H,19,26)/t11-,14-,15+,16+,17-/m0/s1
InChIKey	KYZLRYHVPYVKJF-VGVPKUIYSA-N
Molecular Weight	385.475 g/mol
SMILES	O[C@]1([C@]([C@](Oc2ccc(CNC(=S)OCC(C)C)cc2)(O[C@]([C@@]1(O)[H])(C)[H])[H])(O)[H])[H]
SPLASH	splash10-053r-0900000000-bc44c9ebf749a1ae2c33
Source of Spectrum	KC-0-394-12
Wiley ID	829900