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

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

ID: Reference11290

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1-methyl-4-piperidinyl)amino]-5-[[(phenylamino)carbonyl]amino]-;
NAT19-554071

Formula: C18H28N4O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-[(1-methyl-4-piperidinyl)amino]-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 680
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/17/2022 12:22:38 PM
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Identificators

InChI InChI=1S/C18H28N4O3/c1-22-9-7-14(8-10-22)20-15-12-25-16(17(15)23)11-19-18(24)21-13-5-3-2-4-6-13/h2-6,14-17,20,23H,7-12H2,1H3,(H2,19,21,24)/t15-,16-,17+/m1/s1
InChI Key HFHGUYITTYZCKE-ZACQAIPSSA-N
Canonical SMILES CN1CCC(CC1)NC2COC(C2O)CNC(=O)NC3=CC=CC=C3
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1-methyl-4-piperidinyl)amino]-5-[[(phenylamino)carbonyl]amino]-;
NAT19-554071

In Other Databases

PubChem 75536841
ChEMBL CHEMBL3437377
ChemSpider 29858776