Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O4/c1-7-20(4)12-9-17-21(5)11-8-10-19(3,14-25-15(2)23)18(21)16(24)13-22(17,6)26-20/h7,17-18H,1,8-14H2,2-6H3/t17-,18+,19+,20-,21-,22-/m0/s1
InChIKey: InChIKey=OPNYNLBKTFSRRR-ZCPXKWAGSA-N
Formula: C22H34O4
Molecular Weight: 362.503795
Exact Mass: 362.24571
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Garcia-Granados, A., Gutierrez, J.J., Martinez, A., Rivas, F., Arias, J.M. Phytochemistry (1997) 45, 283-91
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)
Position | PPM |
---|---|
1 (CH2) | 39.4 |
2 (CH2) | 17.5 |
3 (CH2) | 36.1 |
4 (C) | 35.6 |
5 (CH) | 60.7 |
6 (C) | 208.7 |
7 (CH2) | 59.9 |
8 (C) | 77.9 |
9 (CH) | 58.7 |
10 (C) | 40.1 |
11 (CH2) | 16.6 |
12 (CH2) | 34.4 |
13 (C) | 74.3 |
14 (CH) | 146.6 |
15 (CH2) | 110.3 |
16 (CH3) | 32.5 |
17 (CH3) | 24.4 |
18 (CH2) | 71.7 |
19 (CH3) | 17.6 |
20 (CH3) | 17.1 |
18a (C) | 170.9 |
18b (CH3) | 21 |