Systematic / IUPAC Name: N-[(3S,3aR,6S,6aR)-3-[[4-(Furan-2-yl)pyrimidin-2-yl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]cyclopropanecarboxamide
ID: Reference9572
Other Names:
L-Iditol, 1,4:3,6-dianhydro-2-[(cyclopropylcarbonyl)amino]-2,5-dideoxy-5-[[4-(2-furanyl)-2-pyrimidinyl]amino]-;
NAT6-320214
Formula: C18H20N4O4
1,4:3,6-Dianhydro-2-[(cyclopropylcarbonyl)amino]-2,5-dideoxy-5-{[4-(2-furyl)-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.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 2 |
No. of Spectra | 2242 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 4/3/2020 2:55:08 PM |
InChI | InChI=1S/C18H20N4O4/c23-17(10-3-4-10)20-12-8-25-16-13(9-26-15(12)16)22-18-19-6-5-11(21-18)14-2-1-7-24-14/h1-2,5-7,10,12-13,15-16H,3-4,8-9H2,(H,20,23)(H,19,21,22)/t12-,13-,15+,16+/m0/s1 |
InChI Key | FRVHLDPRFCLSTM-WMHQRMGPSA-N |
Canonical SMILES | C1CC1C(=O)NC2COC3C2OCC3NC4=NC=CC(=N4)C5=CC=CO5 |
CAS | |
Splash | |
Other Names |
L-Iditol, 1,4:3,6-dianhydro-2-[(cyclopropylcarbonyl)amino]-2,5-dideoxy-5-[[4-(2-furanyl)-2-pyrimidinyl]amino]-; NAT6-320214 |