4-[p-(beta-D-glucosylthio)phenyl]-3-thiosemicarbazide, tetraacetate

SpectraBase Compound ID	82lKJj0ojlr
InChI	InChI=1S/C21H27N3O9S2/c1-10(25)29-9-16-17(30-11(2)26)18(31-12(3)27)19(32-13(4)28)20(33-16)35-15-7-5-14(6-8-15)23-21(34)24-22/h5-8,16-20H,9,22H2,1-4H3,(H2,23,24,34)/t16-,17-,18+,19-,20+/m1/s1
InChIKey	SOXZFTWVAHQILZ-OBKDMQGPSA-N Google Search
Mol Weight	529.58 g/mol
Molecular Formula	C21H27N3O9S2
Exact Mass	529.118872 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	H73oAXL8pmJ
Name	4-[p-(beta-D-GLUCOSYLTHIO)PHENYL]-3-THIOSEMICARBAZIDE, TETRAACETATE
Source of Sample	G. Wagner, Karl-Marx University, Leipzig, Germany
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H27N3O9S2
InChI	InChI=1S/C21H27N3O9S2/c1-10(25)29-9-16-17(30-11(2)26)18(31-12(3)27)19(32-13(4)28)20(33-16)35-15-7-5-14(6-8-15)23-21(34)24-22/h5-8,16-20H,9,22H2,1-4H3,(H2,23,24,34)/t16-,17-,18+,19-,20+/m1/s1
InChIKey	SOXZFTWVAHQILZ-OBKDMQGPSA-N
Literature Reference	Abstract-Chemical Abstracts= 60, 4239(1964)
Melting Point	168-171C
Molecular Weight	529.578979
Optical Properties	Optical Rotation= (19C) -46.1 DEG (c=4.0, CHLOROFORM)
Synonyms	SEMICARBAZIDE, 4-/P-/B-D-GLUCO- PYRANOSYLTHIO/PHENYL/-3-THIO-, 2PR,- 3PR,4PR,6PR-TETRAACETATE, /MINUS/-, SEMICARBAZIDE, 4-/P-/B-D-GLUCOSYL- THIO/PHENYL/-3-THIO-, 2PR,3PR,4PR,6PR- TETRAACETATE, /MINUS/-, GLUCOPYRANOSIDE, /P-/3-AMINO-2- THIOUREIDO/PHENYL/ 1-THIO-, TETRA- ACETATE /ESTER/, B-D-/MINUS/-,
Technique	KBr WAFER