Spektraris NMR
2a,7a,15,19-Tetrahydroxy-ent-labda-8(17),(13Z)-diene
Common Name: 2a,7a,15,19-Tetrahydroxy-ent-labda-8(17),(13Z)-diene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O4/c1-13(7-8-21)5-6-16-14(2)17(24)9-18-19(3,12-22)10-15(23)11-20(16,18)4/h7,15-18,21-24H,2,5-6,8-12H2,1,3-4H3/b13-7-/t15-,16+,17+,18+,19+,20+/m1/s1
InChIKey: InChIKey=LCWHTWNKEOSQBZ-UJSJCHNZSA-N
Formula: C20H34O4
Molecular Weight: 338.482323
Exact Mass: 338.24571
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Fragoso-Serrano, M., Gonzalez-Chimeo, E., Pereda-Miranda, R. J Nat Prod (1999) 62, 45-50
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) | 41.3 |
| 2 (CH) | 65.5 |
| 3 (CH2) | 45.1 |
| 4 (C) | 41.2 |
| 5 (CH) | 54.4 |
| 6 (CH2) | 34.2 |
| 7 (CH) | 74.7 |
| 8 (C) | 151.2 |
| 9 (CH) | 55.2 |
| 10 (C) | 41.3 |
| 11 (CH2) | 22.7 |
| 12 (CH2) | 31.1 |
| 13 (C) | 139.8 |
| 14 (CH) | 126.3 |
| 15 (CH2) | 59.3 |
| 16 (CH3) | 23.5 |
| 17 (CH2) | 104.6 |
| 18 (CH3) | 28.2 |
| 19 (CH2) | 65.5 |
| 20 (CH3) | 16.7 |
