Spektraris NMR
Volvatrate A
Common Name: Volvatrate A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H24O8/c1-8(2)5-12(19)24-15-13-16(20)6-11(23-10(4)18)17(13,21)7-22-14(25-15)9(16)3/h8,11,13-15,20-21H,3,5-7H2,1-2,4H3/t11-,13-,14+,15+,16-,17+/m0/s1
InChIKey: InChIKey=FZPVNGODHKVGGJ-IAPUWKBBSA-N
Formula: C17H24O8
Molecular Weight: 356.368328
Exact Mass: 356.147118
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wang, P.C., Hu, J.M., Ran, X.H., Chen, Z.Q., Jiang, H.Z., Liu, Y.Q., Zhou, J., Zhao, Y.X. J Nat Prod (2009) 72, 1682-5
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : Iridoids; 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) | 91.2 |
| 3 (CH) | 96.3 |
| 4 (C) | 149.9 |
| 5 (C) | 74.4 |
| 6 (CH2) | 47.1 |
| 7 (CH) | 79 |
| 8 (C) | 79.4 |
| 9 (CH) | 57.3 |
| 10 (CH2) | 66.7 |
| 11 (CH2) | 110.5 |
| 1a (C) | 170.9 |
| 1b (CH2) | 43.3 |
| 1c (CH) | 25.7 |
| 1d (CH3) | 22.3 |
| 1e (CH3) | 22.3 |
| 7a (C) | 170.9 |
| 7b (CH3) | 21.1 |
