CIS-ROTAMER
Compound with spectra: 1 NMR
| SpectraBase Compound ID | BXDjWp4dXxW |
|---|---|
| InChI | InChI=1S/C37H42N2O8/c1-24(40)47-34(20-26-13-17-30(18-14-26)46-23-27-11-7-4-8-12-27)35(42)38-31(19-25-9-5-3-6-10-25)36(43)39-32-22-29(41)16-15-28(32)21-33(39)37(44)45-2/h3-14,17-18,28-29,31-34,41H,15-16,19-23H2,1-2H3,(H,38,42)/t28-,29+,31-,32-,33-,34-/m0/s1 |
| InChIKey | NPZUIOHYMOGMCE-KOQULBODSA-N |
| Mol Weight | 642.7 g/mol |
| Molecular Formula | C37H42N2O8 |
| Exact Mass | 642.294116 g/mol |
| Enantiomer InChIKey | NPZUIOHYMOGMCE-XVNNQTSKSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
AERUGINOSIN_KT_650;MAJOR_CIS_ROTAMER
AERUGINOSIN_KT_650;MINOR_TRANS_ROTAMER
PUFNADSPAVNISU-ZJIIMNLKSA-N
AERUGINOSIN_DA642B;D-ORTHO-CL-HPLA-L-PHE-L-CHOI-AGMATINE;MAJOR_ROTAMER;TRANS
AERUGINOSIN_DA642A;L-ORTHO-CL-HPLA-L-PHE-L-CHOI-AGMATINE;MAJOR_ROTAMER;TRANS
HO-D-HPLA-D-TYR-L-CHOI-L-ARGOL
HO-D-HPLA-D-PHE(4-F)-L-CHOI-L-ARGOL
1H-INDOLE-2-CARBOXAMIDE, N-[4-[(AMINOIMINOETHYL)AMINO]BUTYL]OCTAHYDRO-1-[2-[[2-HYDROXY-3-(3-CHLORO-4-HYDROXYPHENYL)-1-OXOPROPYL]AMINO]-3-METHYL-1-OXOPENTYL]-6-(SULFOOXY)-
AERUGINOSIN_GE686;D-M-BR-M'-CL-P-HPLA-D-ALLO-ILE-L-CHOI-AGMATIME
AERUGINOSIN_GE730;D-M,M-DI-BR-P-HPLA-D-ALLO-ILE-L-CHOI-AGMATIME
| Title | Journal or Book | Year |
|---|---|---|
| Synthesis of Microcin SF608 | The Journal of Organic Chemistry | 2002 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.