Spektraris NMR
Basiliolide B
Common Name: Basiliolide B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H24O7/c1-6-19(2)8-7-13-20(3,18(24)26-5)12-9-11-10-14(25-4)27-17(23)15(19)21(11,13)28-16(12)22/h6,9-10,12-13,15H,1,7-8H2,2-5H3/t12-,13+,15+,19+,20-,21-/m1/s1
InChIKey: InChIKey=UTAYDCZHINEPNU-UPARIUTJSA-N
Formula: C21H24O7
Molecular Weight: 388.411866
Exact Mass: 388.152203
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Appendino, G., Prosperini, S., Valdivia, C., Ballero, M., Colombano, G., Billington, R.A., Genazzani, A.A., Sterner, O. J Nat Prod (2005) 68, 1213-7
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Miscellanea; 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) | 139.3 |
| 2 (CH) | 123.5 |
| 3 (CH) | 50 |
| 4 (C) | 44.7 |
| 5 (CH) | 44.8 |
| 6 (CH2) | 20.8 |
| 7 (CH2) | 40.2 |
| 8 (C) | 38.5 |
| 9 (CH) | 53.3 |
| 10 (C) | 87 |
| 11 (CH) | 142.7 |
| 12 (CH2) | 112.2 |
| 13 (CH3) | 28.6 |
| 14 (CH3) | 20.9 |
| 15 (C) | 175.2 |
| 16 (C) | 170 |
| 17 (CH) | 79.2 |
| 18 (C) | 156.8 |
| 19 (C) | 162.3 |
| 15a (CH3) | 56.4 |
| 18a (CH3) | 52.8 |
