40591-65-9
2-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-THIOPSEUDOUREA HYDROBROMIDE
Name
2-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-THIOPSEUDOUREA HYDROBROMIDE
pro_formula
C15 H22 N2 O9 S . Br H
pro_molWeight
487.322
1Identification
【Name】
2-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-THIOPSEUDOUREA HYDROBROMIDE
【CAS】
【MDL】
MFCD00058238
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H22 N2 O9 S . Br H
【pro_molWeight】
487.322
【Inchi】
InChI=1S/C15H22N2O9S.BrH/c1-6(18)22-5-10-11(23-7(2)19)12(24-8(3)20)13(25-9(4)21)14(26-10)27-15(16)17;/h10-14H,5H2,1-4H3,(H3,16,17);1H/t10-,11-,12+,13-,14+;/m1./s1
【InChIKey】
InChIKey=QNVDHERXTIAGPT-SXQUUHMTSA-N
【SMILES】
CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)SC(=N)N)OC(=O)C)OC(=O)C)OC(=O)C.Br
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:11
XLogP3:-4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-THIOPSEUDOUREA HYDROBROMIDE.cml
quick_release
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香港先进技术工业有限公司
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