1,4-Anhydro-2-[(4-carboxybenzyl)amino]-2,5-dideoxy-5-[(phenylcarbamoyl)amino]-D-arabinitol

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Systematic / IUPAC Name: 4-[[[(3R,4S,5R)-4-Hydroxy-5-[(phenylcarbamoylamino)methyl]oxolan-3-yl]amino]methyl]benzoic acid

ID: Reference11961

Other Names: D-Arabinitol, 1,4-anhydro-2-[[(4-carboxyphenyl)methyl]amino]-2,5-dideoxy-5-[[(phenylamino)carbonyl]amino]-;
NAT19-551925

Formula: C20H23N3O5

Spectral Data

1,4-Anhydro-2-[(4-carboxybenzyl)amino]-2,5-dideoxy-5-[(phenylcarbamoyl)amino]-D-arabinitol 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 1
No. of Spectra 1339
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/16/2022 9:36:02 AM
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Identificators

InChI InChI=1S/C20H23N3O5/c24-18-16(21-10-13-6-8-14(9-7-13)19(25)26)12-28-17(18)11-22-20(27)23-15-4-2-1-3-5-15/h1-9,16-18,21,24H,10-12H2,(H,25,26)(H2,22,23,27)/t16-,17-,18+/m1/s1
InChI Key JABVHEMTEUKHFF-KURKYZTESA-N
Canonical SMILES C1C(C(C(O1)CNC(=O)NC2=CC=CC=C2)O)NCC3=CC=C(C=C3)C(=O)O
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2-[[(4-carboxyphenyl)methyl]amino]-2,5-dideoxy-5-[[(phenylamino)carbonyl]amino]-;
NAT19-551925

In Other Databases

PubChem 75536775
ChemSpider 29858701