Spektraris NMR
Cyclosin
Common Name: Cyclosin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H12O5/c1-20-14-5-2-9(6-13(14)18)12-8-21-15-7-10(17)3-4-11(15)16(12)19/h2-8,17-18H,1H3
InChIKey: InChIKey=ZZAJQOPSWWVMBI-UHFFFAOYSA-N
Formula: C16H12O5
Molecular Weight: 284.264088
Exact Mass: 284.068473
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Kobayashi, M., Noguchi, H., Sankawa, U. Chem Pharm Bull (1985) 33, 3811-6
Species:
Notes: Family : Flavonoids, Type : Isoflavonoids, Group : Isoflavones; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 2 (CH) | 154.8 |
| 3 (C) | 125.2 |
| 4 (C) | 178 |
| 5 (CH) | 128.5 |
| 6 (CH) | 112.7 |
| 7 (C) | 164.6 |
| 8 (CH) | 103.3 |
| 9 (C) | 159.8 |
| 10 (C) | 118.2 |
| 1' (C) | 125.8 |
| 2' (CH) | 116.5 |
| 3' (C) | 147.4 |
| 4' (C) | 149.2 |
| 5' (CH) | 117.4 |
| 6' (CH) | 121.7 |
| 4'a (CH3) | 56.5 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.