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MONO-[6-DEOXY-6-(2-BUTENEDINITRILE-2,3-DIMERCAPTO-SODIUM-SALT)]-BETA-CYCLODEXTRINE

Compound with spectra: 1 NMR

MONO-[6-DEOXY-6-(2-BUTENEDINITRILE-2,3-DIMERCAPTO-SODIUM-SALT)]-BETA-CYCLODEXTRINE
SpectraBase Compound ID DNS8IYnFaes
InChI InChI=1S/C46H70N2O35S2.Na/c47-1-17(84)18(2-48)85-69-9-16-39-25(61)32(68)46(76-16)82-38-15(8-54)74-44(30(66)23(38)59)80-36-13(6-52)72-42(28(64)21(36)57)78-34-11(4-50)70-40(26(62)19(34)55)77-33-10(3-49)71-41(27(63)20(33)56)79-35-12(5-51)73-43(29(65)22(35)58)81-37-14(7-53)75-45(83-39)31(67)24(37)60;/h10-16,19-46,49-68,84H,3-9H2;/q;+1/p-1/b18-17-;/t10-,11+,12+,13+,14+,15-,16-,19+,20-,21+,22+,23-,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34+,35+,36+,37+,38-,39-,40+,41-,42+,43+,44-,45+,46-;/m1./s1
InChIKey VXPPFEWOUGNQDL-HAGLLSKASA-M
Mol Weight 1297.1 g/mol
Molecular Formula C46H69N2NaO35S2
Exact Mass 1296.301999 g/mol
Parent InChIKey GIYXLIXASYMBTA-OFEBNDPBSA-M
Enantiomer InChIKey VXPPFEWOUGNQDL-YDNAFLSQSA-M

View Spectrum of MONO-[6-DEOXY-6-(2-BUTENEDINITRILE-2,3-DIMERCAPTO-SODIUM-SALT)]-BETA-CYCLODEXTRINE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
6-O-Butyryl.beta.-D-maltotriose
METHYL-O-beta-D-GALAKTOPYRANOSYL-(1->4)-O-beta-D-GLUCOPYRANOYL-(1->4)-O-3-O-beta-D-GALAKTOPYRANOSYL-(1->4)
(4R,5S,6R)-5-[(BETA-D-GLUCOPYRANOSYL)-(1-4)-O-(BETA-D-GLUCOSYL)-(1-4)-O-(BETA-D-GLUCOSYL)]-OXY-4-HYDROXY-6-HYDROXYMETHYL-3,4,5,6-TETRAHYDRO-2H-1,2
(4R,5S,6R)-5-[(BETA-D-GLUCOPYRANOSYL)-(1->4)-O-(BETA-D-GLUCOSYL)]-OXY-4-HYDROXY-6-HYDROXYMETHYL-3,4,5,6-TETRAHYDRO-2H-1,2-OXAZINE
4-HYDROXYPHENYL-BETA-MALTOTRIOSIDE
(3R,4R,5R)-4-[(BETA-D-GLUCOPYRANOSYL)-(1->4)-O-(BETA-D-GLUCOSYL)-(1->4)-O-(BETA-D-GLUCOSYL)]-OXY-3-HYDROXY-5-(HYDROXYMETHYL)-PIPERIDINE
(3R,4R,5R)-4-[(BETA-D-GLUCOPYRANOSYL)-(1->4)-O-(BETA-D-GLUCOSYL)]-OXY-3-HYDROXY-5-(HYDROXYMETHYL)-PIPERIDINE
METHYL-O-beta-D-GALAKTOPYRANOSYL-(1->4)-O-beta-D-GLUCOPYRANOYL-(1->4)-O-beta-D-GLUCOPYRANOSYL-(1->6)-O-beta-D-GLUCOPYRANOSIDE
MONO-(6-DEOXY-6-THIODECAMETHYLENETHIOL)-BETA-CYCLODEXTRIN;CD(10)
ALAM-BETA-CD;MONO-6-N-ALLYLAMMONIUM-6-DEOXY-BETA-CYCLODEXTRIN-CHLORIDE
Title Journal or Book Year
An Antitumor Agent of .BETA.-Cyclodextrin-Modified Titanocene Complex: Synthesis and Characterization Chemical and Pharmaceutical Bulletin 2003
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