Systematic / IUPAC Name: 1-[[(2R,3S,4R,5S)-5-[2-(2,3-Dihydroindol-1-yl)-2-oxoethyl]-3,4-dihydroxyoxolan-2-yl]methyl]-3-(3-methoxyphenyl)urea
ID: Reference9187
Other Names: NAT19-353684
Formula: C23H27N3O6
1-({(2R,3S,4R,5S)-5-[2-(2,3-Dihydro-1H-indol-1-yl)-2-oxoethyl]-3,4-dihydroxytetrahydro-2-furanyl}methyl)-3-(3-methoxyphenyl)urea 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 FAIMS |
No. of Spectral Trees | 2 |
No. of Spectra | 4021 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 12/2/2019 2:03:00 PM |
InChI | InChI=1S/C23H27N3O6/c1-31-16-7-4-6-15(11-16)25-23(30)24-13-19-22(29)21(28)18(32-19)12-20(27)26-10-9-14-5-2-3-8-17(14)26/h2-8,11,18-19,21-22,28-29H,9-10,12-13H2,1H3,(H2,24,25,30)/t18-,19+,21-,22+/m0/s1 |
InChI Key | PBLYRMVTGLXGEA-YUVXSKOASA-N |
Canonical SMILES | COC1=CC=CC(=C1)NC(=O)NCC2C(C(C(O2)CC(=O)N3CCC4=CC=CC=C43)O)O |
CAS | |
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Other Names | NAT19-353684 |