5-O-[(4-Acetylphenyl)carbamoyl]-1,4:3,6-dianhydro-2-deoxy-2-{[4-(2-furyl)-2-pyrimidinyl]amino}-D-glucitol

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Systematic / IUPAC Name: [(3S,3aR,6R,6aS)-3-[[4-(Furan-2-yl)pyrimidin-2-yl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-(4-acetylphenyl)carbamate

ID: Reference10485

Other Names: NAT6-318611

Formula: C23H22N4O6

Spectral Data

5-O-[(4-Acetylphenyl)carbamoyl]-1,4:3,6-dianhydro-2-deoxy-2-{[4-(2-furyl)-2-pyrimidinyl]amino}-D-glucitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 2
No. of Spectra 3760
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/21/2021 12:42:35 PM
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Identificators

InChI InChI=1S/C23H22N4O6/c1-13(28)14-4-6-15(7-5-14)25-23(29)33-19-12-32-20-17(11-31-21(19)20)27-22-24-9-8-16(26-22)18-3-2-10-30-18/h2-10,17,19-21H,11-12H2,1H3,(H,25,29)(H,24,26,27)/t17-,19+,20+,21+/m0/s1
InChI Key NMYQEKDMTRXZHA-OYNPSCLESA-N
Canonical SMILES CC(=O)C1=CC=C(C=C1)NC(=O)OC2COC3C2OCC3NC4=NC=CC(=N4)C5=CC=CO5
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Other Names NAT6-318611

In Other Databases

PubChem 11913048
ChemSpider 10087371