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

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

ID: Reference11502

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(3-pyridinylmethyl)amino]-5-[(2-thienylcarbonyl)amino]-;
NAT19-551328

Formula: C16H19N3O3S

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-[(3-pyridinylmethyl)amino]-5-[(2-thienylcarbonyl)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 1249
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/23/2022 2:24:31 PM
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Identificators

InChI InChI=1S/C16H19N3O3S/c20-15-12(18-8-11-3-1-5-17-7-11)10-22-13(15)9-19-16(21)14-4-2-6-23-14/h1-7,12-13,15,18,20H,8-10H2,(H,19,21)/t12-,13-,15+/m1/s1
InChI Key AMMYWHUULNJIRS-NFAWXSAZSA-N
Canonical SMILES C1C(C(C(O1)CNC(=O)C2=CC=CS2)O)NCC3=CN=CC=C3
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(3-pyridinylmethyl)amino]-5-[(2-thienylcarbonyl)amino]-;
NAT19-551328

In Other Databases

PubChem 75536605
ChemSpider 29858502