Spektraris NMR
(24E)-6beta-Hydroxydammara-20,24-diene-3,26-dione
Common Name: (24E)-6beta-Hydroxydammara-20,24-diene-3,26-dione
Synonyms: (24E)-6beta-Hydroxydammara-20,24-diene-3,26-dione
CAS Registry Number:
InChI: InChI=1S/C30H46O3/c1-19(18-31)9-8-10-20(2)21-13-16-29(6)22(21)11-12-24-28(5)15-14-25(33)27(3,4)26(28)23(32)17-30(24,29)7/h9,18,21-24,26,32H,2,8,10-17H2,1,3-7H3/b19-9+/t21-,22-,23-,24-,26+,28-,29-,30-/m1/s1
InChIKey: InChIKey=CPCXHJGLQHAOKZ-NBHGOMHUSA-N
Formula: C30H46O3
Molecular Weight: 454.685566
Exact Mass: 454.344695
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chavez, H., Estevez-Braun, A., Ravelo, A.G., Gonzalez, A.G. Tetrahedron (1997) 53, 6465-72
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) | 43 |
| 2 (CH2) | 34.4 |
| 3 (C) | 216.55 |
| 4 (C) | 49.06 |
| 5 (CH) | 56.98 |
| 6 (CH) | 69.6 |
| 7 (CH2) | 42.45 |
| 8 (C) | 39.61 |
| 9 (CH) | 51.05 |
| 10 (C) | 36.84 |
| 11 (CH2) | 21.61 |
| 12 (CH2) | 24.96 |
| 13 (CH) | 44.34 |
| 14 (C) | 49.43 |
| 15 (CH2) | 31.33 |
| 16 (CH2) | 27.55 |
| 17 (CH) | 47.37 |
| 18 (CH3) | 15.99 |
| 19 (CH3) | 16.52 |
| 20 (C) | 151.03 |
| 21 (CH2) | 108.43 |
| 22 (CH2) | 32.69 |
| 23 (CH2) | 28.95 |
| 24 (CH) | 154.39 |
| 25 (C) | 139.37 |
| 26 (CH) | 195.28 |
| 27 (CH3) | 9.28 |
| 28 (CH3) | 23.67 |
| 29 (CH3) | 24.87 |
| 30 (CH3) | 16.91 |
