1,4:3,6-Dianhydro-2-({[1-(carboxymethyl)cyclopentyl]acetyl}amino)-2,5-dideoxy-5-{[4-(2-methyl-2-propanyl)-2-pyrimidinyl]amino}-L-iditol

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Systematic / IUPAC Name: 2-[1-[2-[[(3S,3aR,6S,6aR)-3-[(4-tert-Butylpyrimidin-2-yl)amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]amino]-2-oxoethyl]cyclopentyl]acetic acid

ID: Reference10516

Other Names: NAT6-319706

Formula: C23H34N4O5

Spectral Data

1,4:3,6-Dianhydro-2-({[1-(carboxymethyl)cyclopentyl]acetyl}amino)-2,5-dideoxy-5-{[4-(2-methyl-2-propanyl)-2-pyrimidinyl]amino}-L-iditol 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 2763
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/4/2021 11:27:06 AM
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Identificators

InChI InChI=1S/C23H34N4O5/c1-22(2,3)16-6-9-24-21(27-16)26-15-13-32-19-14(12-31-20(15)19)25-17(28)10-23(11-18(29)30)7-4-5-8-23/h6,9,14-15,19-20H,4-5,7-8,10-13H2,1-3H3,(H,25,28)(H,29,30)(H,24,26,27)/t14-,15-,19+,20+/m0/s1
InChI Key ISOFICMSLMZRLW-IQGAEYHTSA-N
Canonical SMILES CC(C)(C)C1=NC(=NC=C1)NC2COC3C2OCC3NC(=O)CC4(CCCC4)CC(=O)O
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Other Names NAT6-319706

In Other Databases

PubChem 11912942
ChemSpider 10087265