Spektraris NMR
Pulchellamine A
Common Name: Pulchellamine A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H26N2O7/c1-7-3-13(23)16-10(6-21-11(18(25)26)5-14(20)24)19(27)28-17(16)15-8(2)12(22)4-9(7)15/h9-13,15-17,21-23H,1-6H2,(H2,20,24)(H,25,26)/t9-,10-,11-,12-,13-,15-,16+,17+/m0/s1
InChIKey: InChIKey=YEGRITYHHMCDPK-DNTBNWOGSA-N
Formula: C19H26N2O7
Molecular Weight: 394.419762
Exact Mass: 394.174001
NMR Solvent: D2O
MHz:
Calibration:
NMR references: 13C - Yang, M.C., Choi, S.U., Choi, W.S., Kim, S.Y., Lee, K.R. J Nat Prod (2008) 71, 678-83
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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 (CH) | 43 |
| 2 (CH2) | 37.8 |
| 3 (CH) | 72.8 |
| 4 (C) | 153 |
| 5 (CH) | 49.1 |
| 6 (CH) | 80.9 |
| 7 (CH) | 53.6 |
| 8 (CH) | 73.5 |
| 9 (CH2) | 43.7 |
| 10 (C) | 143.6 |
| 11 (CH) | 44.5 |
| 12 (C) | 177.8 |
| 13 (CH2) | 47.3 |
| 14 (CH2) | 116.2 |
| 15 (CH2) | 111 |
| 13a (CH) | 59.3 |
| 13b (CH2) | 33.9 |
| 13c (C) | 172.8 |
| 13aa (C) | 174.5 |
