Spektraris NMR
Sinulodurin B
Common Name: Sinulodurin B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H32O3/c1-13(2)11-21(24)22(25-17(6)23)16(5)19-10-8-15(4)18-9-7-14(3)12-20(18)19/h11-12,15-16,18-19,22H,3,7-10H2,1-2,4-6H3/t15-,16+,18+,19+,22?/m1/s1
InChIKey: InChIKey=ALKQOCXLHHKOJQ-CPDLSWESSA-N
Formula: C22H32O3
Molecular Weight: 344.488509
Exact Mass: 344.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Radwan, M.M., Manly, S.P., El Sayed, K.A., Wali, V.B., Sylvester, P.W., Awate, B., Shah, G., Ross, S.A. J Nat Prod (2008) 71, 1468-71
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Serrulatanes; 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) | 34.7 |
| 2 (CH2) | 29 |
| 3 (CH2) | 29.3 |
| 4 (CH) | 33.5 |
| 5 (CH) | 128.5 |
| 6 (C) | 143.2 |
| 7 (CH2) | 27.1 |
| 8 (CH2) | 29 |
| 9 (CH) | 37.2 |
| 10 (C) | 141.6 |
| 11 (CH) | 46.8 |
| 12 (CH) | 79.9 |
| 13 (C) | 196.9 |
| 14 (CH) | 119.6 |
| 15 (C) | 158.5 |
| 16 (CH3) | 28.1 |
| 17 (CH3) | 21.1 |
| 18 (CH3) | 14.6 |
| 19 (CH2) | 109.5 |
| 20 (CH3) | 11.9 |
| 12a (C) | 170.4 |
| 12b (CH3) | 20.8 |
