1,4-Anhydro-2,5-dideoxy-5-[(phenylcarbamoyl)amino]-2-[(3-pyridinylmethyl)amino]-D-arabinitol

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Systematic / IUPAC Name: 1-[[(2R,3S,4R)-3-Hydroxy-4-(pyridin-3-ylmethylamino)oxolan-2-yl]methyl]-3-phenylurea

ID: Reference11485

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[[(phenylamino)carbonyl]amino]-2-[(3-pyridinylmethyl)amino]-;
NAT19-551928

Formula: C18H22N4O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(phenylcarbamoyl)amino]-2-[(3-pyridinylmethyl)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 1570
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/22/2022 12:24:34 PM
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Identificators

InChI InChI=1S/C18H22N4O3/c23-17-15(20-10-13-5-4-8-19-9-13)12-25-16(17)11-21-18(24)22-14-6-2-1-3-7-14/h1-9,15-17,20,23H,10-12H2,(H2,21,22,24)/t15-,16-,17+/m1/s1
InChI Key LLOMGTSPXDDZDW-ZACQAIPSSA-N
Canonical SMILES C1C(C(C(O1)CNC(=O)NC2=CC=CC=C2)O)NCC3=CN=CC=C3
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[[(phenylamino)carbonyl]amino]-2-[(3-pyridinylmethyl)amino]-;
NAT19-551928

In Other Databases

PubChem 75536777
ChemSpider 29858703