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

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

ID: Reference12379

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[[(phenylmethyl)amino]carbonyl]amino]-, 5-[(4-phenoxyphenyl)carbamate];
NAT6-270104

Formula: C27H27N3O6

Spectral Data

1,4:3,6-Dianhydro-2-[(benzylcarbamoyl)amino]-2-deoxy-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.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1859
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/17/2023 2:58:00 PM
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Identificators

InChI InChI=1S/C27H27N3O6/c31-26(28-15-18-7-3-1-4-8-18)30-22-16-33-25-23(17-34-24(22)25)36-27(32)29-19-11-13-21(14-12-19)35-20-9-5-2-6-10-20/h1-14,22-25H,15-17H2,(H,29,32)(H2,28,30,31)/t22-,23+,24+,25+/m0/s1
InChI Key WMSRYTAAHFWPBH-ZYQDXHPFSA-N
Canonical SMILES C1C(C2C(O1)C(CO2)OC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)NC(=O)NCC5=CC=CC=C5
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[[(phenylmethyl)amino]carbonyl]amino]-, 5-[(4-phenoxyphenyl)carbamate];
NAT6-270104

In Other Databases

PubChem 11884040
ChemSpider 10058368