Spektraris NMR
15?-Hydroxymansumbinone
Common Name: 15?-Hydroxymansumbinone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O2/c1-19(2)15-10-13-21(4)16(20(15,3)12-11-17(19)23)8-6-14-7-9-18(24)22(14,21)5/h7,9,14-16,18,24H,6,8,10-13H2,1-5H3/t14-,15+,16-,18+,20+,21-,22+/m1/s1
InChIKey: InChIKey=IZVSYFSOPGJXBC-VTTGRNCBSA-N
Formula: C22H34O2
Molecular Weight: 330.504985
Exact Mass: 330.25588
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Dekebo, A., Dagne, E., Hansen, L.K., Gautun, O.R., Aasen, A.J. Phytochemistry (2002) 59, 399-403
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Dammaranes; 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) | 40 |
| 2 (CH2) | 34.1 |
| 3 (C) | 218 |
| 4 (C) | 47.5 |
| 5 (CH) | 55.3 |
| 6 (CH2) | 19.6 |
| 7 (CH2) | 35.7 |
| 8 (C) | 40.4 |
| 9 (CH) | 50.5 |
| 10 (C) | 37.1 |
| 11 (CH2) | 22.3 |
| 12 (CH2) | 24.4 |
| 13 (CH) | 46.2 |
| 14 (C) | 58.7 |
| 15 (CH) | 79.1 |
| 16 (CH) | 133.9 |
| 17 (CH) | 134.6 |
| 18 (CH3) | 17.9 |
| 19 (CH3) | 16.1 |
| 28 (CH3) | 26.8 |
| 29 (CH3) | 21 |
| 30 (CH3) | 9.7 |
