1,4:3,6-Dianhydro-2-deoxy-2-{[4-(4-methoxyphenyl)-2-pyrimidinyl]amino}-5-O-[(4-phenoxyphenyl)carbamoyl]-D-glucitol

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

ID: Reference9199

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[4-(4-methoxyphenyl)-2-pyrimidinyl]amino]-, 5-[(4-phenoxyphenyl)carbamate];
NAT6-318837

Formula: C30H28N4O6

Spectral Data

1,4:3,6-Dianhydro-2-deoxy-2-{[4-(4-methoxyphenyl)-2-pyrimidinyl]amino}-5-O-[(4-phenoxyphenyl)carbamoyl]-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 FAIMS
No. of Spectral Trees 1
No. of Spectra 2983
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 12/9/2019 10:06:35 AM
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Identificators

InChI InChI=1S/C30H28N4O6/c1-36-21-11-7-19(8-12-21)24-15-16-31-29(33-24)34-25-17-37-28-26(18-38-27(25)28)40-30(35)32-20-9-13-23(14-10-20)39-22-5-3-2-4-6-22/h2-16,25-28H,17-18H2,1H3,(H,32,35)(H,31,33,34)/t25-,26+,27+,28+/m0/s1
InChI Key OJSHMPWNAZGHHY-KUXCXQDQSA-N
Canonical SMILES COC1=CC=C(C=C1)C2=NC(=NC=C2)NC3COC4C3OCC4OC(=O)NC5=CC=C(C=C5)OC6=CC=CC=C6
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[4-(4-methoxyphenyl)-2-pyrimidinyl]amino]-, 5-[(4-phenoxyphenyl)carbamate];
NAT6-318837

In Other Databases

PubChem 44716812
ChemSpider 21388498