1,4:3,6-Dianhydro-2-deoxy-2-{[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]amino}-5-O-[(4-phenoxyphenyl)carbamoyl]-D-glucitol

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Systematic / IUPAC Name: [(3S,3aR,6R,6aS)-3-[(3,5-Dimethyl-1,2-oxazole-4-carbonyl)amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-(4-phenoxyphenyl)carbamate

ID: Reference12413

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-, 5-[(4-phenoxyphenyl)carbamate];
NAT6-292562

Formula: C25H25N3O7

Spectral Data

1,4:3,6-Dianhydro-2-deoxy-2-{[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]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.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2499
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/31/2023 2:26:41 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C25H25N3O7/c1-14-21(15(2)35-28-14)24(29)27-19-12-31-23-20(13-32-22(19)23)34-25(30)26-16-8-10-18(11-9-16)33-17-6-4-3-5-7-17/h3-11,19-20,22-23H,12-13H2,1-2H3,(H,26,30)(H,27,29)/t19-,20+,22+,23+/m0/s1
InChI Key VTEMNRFURHDZNH-KKSHJYNMSA-N
Canonical SMILES CC1=C(C(=NO1)C)C(=O)NC2COC3C2OCC3OC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-, 5-[(4-phenoxyphenyl)carbamate];
NAT6-292562

In Other Databases

PubChem 11885938
ChemSpider 10060261