Spektraris NMR
Panglimycin A
Common Name: Panglimycin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H20O6/c1-8-5-9-7-13(22)19(25)16(14(9)12(21)6-8)17(23)10-3-2-4-11(20)15(10)18(19)24/h2-4,8,13,16,18,20,22,24-25H,5-7H2,1H3/t8-,13+,16+,18-,19-/m0/s1
InChIKey: InChIKey=PKPHZFVECLENRP-XYOPJOGDSA-N
Formula: C19H20O6
Molecular Weight: 344.359227
Exact Mass: 344.125988
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Fotso, S., Mahmud, T., Zabriskie, T.M., Santosa, D.A., Sulastri, Proteau, P.J. J Nat Prod (2008) 71, 61-5
Species:
Notes: Family : Aromatics, Type : Anthraquinones, Group : Angucyclines; 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) | 197.3 |
| 2 (CH2) | 45.4 |
| 3 (CH) | 30 |
| 4 (CH2) | 39 |
| 4a (C) | 153.3 |
| 5 (CH2) | 38.1 |
| 6 (CH) | 64.3 |
| 6a (C) | 76 |
| 7 (CH) | 74.9 |
| 7a (C) | 126.9 |
| 8 (C) | 155.9 |
| 9 (CH) | 119.9 |
| 10 (CH) | 127.8 |
| 11 (CH) | 115.9 |
| 11a (C) | 133.9 |
| 12 (C) | 193.2 |
| 12a (CH) | 49.7 |
| 12b (C) | 127.1 |
| 13 (CH3) | 21.2 |
