Spektraris NMR
19-[(Z)-3-(4-Hydroxyphenyl)propenoyloxy]labda-13(16),14-diene-8-ol
![19-[(Z)-3-(4-Hydroxyphenyl)propenoyloxy]labda-13(16),14-diene-8-ol](/nmr/static/nmr/svg/1926.svg)
Common Name: 19-[(Z)-3-(4-Hydroxyphenyl)propenoyloxy]labda-13(16),14-diene-8-ol
Synonyms: 19-[(Z)-3-(4-Hydroxyphenyl)propenoyloxy]labda-13(16),14-diene-8-ol
CAS Registry Number:
InChI: InChI=1S/C29H40O4/c1-6-21(2)8-14-25-28(4)18-7-17-27(3,24(28)16-19-29(25,5)32)20-33-26(31)15-11-22-9-12-23(30)13-10-22/h6,9-13,15,24-25,30,32H,1-2,7-8,14,16-20H2,3-5H3/b15-11-/t24-,25+,27+,28-,29+/m0/s1
InChIKey: InChIKey=LXORINFASUBZBQ-DEYDKXAOSA-N
Formula: C29H40O4
Molecular Weight: 452.626591
Exact Mass: 452.29266
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Lin, T.C., Fang, J.M., Cheng, Y.S. Phytochemistry (1999) 51, 793-801
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) | 39.5 |
| 2 (CH2) | 18 |
| 3 (CH2) | 36.2 |
| 4 (C) | 36.9 |
| 5 (CH) | 56.6 |
| 6 (CH2) | 21 |
| 7 (CH2) | 44.5 |
| 8 (C) | 74.5 |
| 9 (CH) | 61.6 |
| 10 (C) | 38.9 |
| 11 (CH2) | 24.6 |
| 12 (CH2) | 34.9 |
| 13 (C) | 147.2 |
| 14 (CH) | 138.7 |
| 15 (CH2) | 113.5 |
| 16 (CH2) | 115.7 |
| 17 (CH3) | 23.8 |
| 18 (CH3) | 27.4 |
| 19 (CH2) | 66.9 |
| 20 (CH3) | 15.9 |
| 19a (C) | 167.2 |
| 19b (CH) | 116.7 |
| 19c (CH) | 143.8 |
| 19d (C) | 126.9 |
| 19e (CH) | 132.2 |
| 19f (CH) | 115.1 |
| 19g (C) | 157.3 |
| 19h (CH) | 115.1 |
| 19i (CH) | 132.2 |
