Spektraris NMR
Coeloginanthridin triacetate
Common Name: Coeloginanthridin triacetate
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H22O8/c1-11(23)28-15-8-14-6-7-16-17(20(14)18(9-15)29-12(2)24)10-19(30-13(3)25)22(27-5)21(16)26-4/h8-10H,6-7H2,1-5H3
InChIKey: InChIKey=OGFPSXYNIOKCSY-UHFFFAOYSA-N
Formula: C22H22O8
Molecular Weight: 414.406126
Exact Mass: 414.131468
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Majumder, P.L., Sen, S., Majumder, S. Phytochemistry (2001) 58, 581-6
Species:
Notes: Family : Aromatics, Type : Phenanthrenes; 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 |
|---|---|
| 1 (C) | 149.3 |
| 2 (C) | 144.1 |
| 3 (C) | 142.5 |
| 4 (CH) | 117.2 |
| 5 (C) | 147.8 |
| 6 (CH) | 115.2 |
| 7 (C) | 151.3 |
| 8 (CH) | 118.6 |
| 9 (CH2) | 29.6 |
| 10 (CH2) | 21.4 |
| 11 (C) | 128.4 |
| 12 (C) | 126.4 |
| 13 (C) | 141.7 |
| 14 (C) | 130.8 |
| 1a (CH3) | 60.7 |
| 2a (CH3) | 60.7 |
| 3a (C) | 168.6 |
| 3b (CH3) | 20.6 |
| 5a (C) | 168.7 |
| 5b (CH3) | 20.9 |
| 7a (C) | 168.8 |
| 7b (CH3) | 21 |
Copyright © 2025
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.