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(-)-4-benzamido-1-(beta-D-glucopyranosyl)-1(2H)-pyrimidinone, tetraacetate
SpectraBase Compound ID 3ayjU9altsX
InChI InChI=1S/C25H27N3O11/c1-13(29)35-12-18-20(36-14(2)30)21(37-15(3)31)22(38-16(4)32)24(39-18)28-11-10-19(27-25(28)34)26-23(33)17-8-6-5-7-9-17/h5-11,18,20-22,24H,12H2,1-4H3,(H,26,27,33,34)/t18-,20-,21+,22-,24-/m1/s1
InChIKey VYJASVSUAPRBNM-BKSKZGTRSA-N
Mol Weight 545.5 g/mol
Molecular Formula C25H27N3O11
Exact Mass 545.164559 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID IrOCslm1il1
Name (-)-4-BENZAMIDO-1-(beta-D-GLUCOPYRANOSYL)-1(2H)-PYRIMIDINONE, TETRAACETATE
Source of Sample N. Yamaoka, Tohoku University, Sendai, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27N3O11
InChI InChI=1S/C25H27N3O11/c1-13(29)35-12-18-20(36-14(2)30)21(37-15(3)31)22(38-16(4)32)24(39-18)28-11-10-19(27-25(28)34)26-23(33)17-8-6-5-7-9-17/h5-11,18,20-22,24H,12H2,1-4H3,(H,26,27,33,34)/t18-,20-,21+,22-,24-/m1/s1
InChIKey VYJASVSUAPRBNM-BKSKZGTRSA-N
Melting Point 260C
Molecular Weight 545.500977
Optical Properties Optical Rotation= (25C) -15 DEG (c=1, CHLOROFORM)
Synonyms PYRIMIDINONE, 1/2H/-, 4-BENZAMIDO- 1-/B-D-GLUCOPYRANOSYL/-, TETRAACETATE, /MINUS/-,
Technique KBr WAFER