Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H36O6/c1-17(25)29-16-21(3)10-6-11-22(4)20(21)8-12-23(5,30-18(2)26)24(22,27)13-7-19-9-14-28-15-19/h9,14-15,20,27H,6-8,10-13,16H2,1-5H3/t20-,21+,22-,23-,24-/m0/s1
InChIKey: InChIKey=ZVDMRIOKPAYXTL-HTUFRPJOSA-N
Formula: C24H36O6
Molecular Weight: 420.539958
Exact Mass: 420.251189
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Papanov, G., Malakov, P., Tomova, K. Phytochemistry (1998) 47, 139-41
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) | 35.4 |
2 (CH2) | 17.8 |
3 (CH2) | 35.8 |
4 (C) | 44.4 |
5 (CH) | 49.7 |
6 (CH2) | 36.1 |
7 (CH2) | 206.4 |
8 (C) | 88.2 |
9 (C) | 81.7 |
10 (C) | 44.5 |
11 (CH2) | 32 |
12 (CH2) | 21.3 |
13 (C) | 124.5 |
14 (CH) | 110.7 |
15 (CH) | 143.2 |
16 (CH) | 138.7 |
17 (CH3) | 25.7 |
18 (CH3) | 17.2 |
19 (CH2) | 67 |
20 (CH3) | 15 |
8a (C) | 169.1 |
8b (CH3) | 21.3 |
19a (C) | 171.2 |
19b (CH3) | 21.2 |