Spektraris NMR
Phorbasin G
Common Name: Phorbasin G
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H37NO4S/c1-17(2)7-5-8-18(3)9-6-10-19(4)20-11-13-21(14-12-20)22(24)23-15-16-28(25,26)27/h6-7,9-10,18,20-21H,5,8,11-16H2,1-4H3,(H,23,24)(H,25,26,27)/b9-6+,19-10+/t18?,20-,21-
InChIKey: InChIKey=GAYAEIJZXLTJRP-GASPETGASA-N
Formula: C22H37N1O4S1
Molecular Weight: 411.600445
Exact Mass: 411.244329
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Lee, H.S., Park, S.Y., Sim, C.J., Rho, J.R. Chem Pharm Bull (2008) 56, 1198-200
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Prenylbisabolanes; 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 (CH2) | 32 |
| 2 (CH2) | 30.7 |
| 3 (CH) | 46.3 |
| 4 (CH2) | 30.7 |
| 5 (CH2) | 32 |
| 6 (CH) | 47.9 |
| 7 (C) | 141.2 |
| 8 (CH) | 124.6 |
| 9 (CH) | 126.5 |
| 10 (CH) | 139.4 |
| 11 (CH) | 38 |
| 12 (CH2) | 38.5 |
| 13 (CH2) | 26.9 |
| 14 (CH) | 125.8 |
| 15 (C) | 132.1 |
| 16 (CH3) | 25.9 |
| 17 (CH3) | 17.8 |
| 18 (CH3) | 21.4 |
| 19 (CH3) | 15 |
| 20 (C) | 178.8 |
| 1' (CH2) | 36.5 |
| 2' (CH2) | 51.4 |
