Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C38H40N2O6/c1-23-18-38-19-29(23)13-14-30(38)36(3)16-15-32(45-34(42)27-9-5-25(20-39)6-10-27)37(4,22-44-24(2)41)31(36)17-33(38)46-35(43)28-11-7-26(21-40)8-12-28/h5-12,29-33H,1,13-19,22H2,2-4H3/t29-,30+,31+,32-,33+,36+,37-,38+/m1/s1
InChIKey: InChIKey=RRHONFVNXOYJQF-IBCJSZHWSA-N
Formula: C38H40N2O6
Molecular Weight: 620.73551
Exact Mass: 620.288637
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bruno, M., Rosselli, S., Pibiri, I., Piozzi, F., Bondi, M.L., Simmonds, M.S. Phytochemistry (2001) 58, 463-74
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 37.7 |
2 (CH2) | 22.7 |
3 (CH) | 75 |
4 (C) | 40.3 |
5 (CH) | 39.5 |
6 (CH2) | 23.7 |
7 (CH) | 80.9 |
8 (C) | 46.7 |
9 (CH) | 51.1 |
10 (C) | 38.4 |
11 (CH2) | 17.6 |
12 (CH2) | 32.9 |
13 (CH) | 43 |
14 (CH2) | 37.5 |
15 (CH2) | 45 |
16 (C) | 153.1 |
17 (CH2) | 104 |
18 (CH2) | 64.3 |
19 (CH3) | 12.9 |
20 (CH3) | 17.6 |
3a (C) | 163.9 |
3b (C) | 134.2 |
3c (CH) | 129.8 |
3d (CH) | 132.1 |
3e (C) | 116.2 |
3f (CH) | 132.1 |
3g (CH) | 129.8 |
3ea (C) | 117.6 |
7a (C) | 163.4 |
7b (C) | 133.9 |
7c (CH) | 129.7 |
7d (CH) | 131.9 |
7e (C) | 116 |
7f (CH) | 131.9 |
7g (CH) | 129.7 |
7ea (C) | 117.5 |
18a (C) | 169.9 |
18b (CH3) | 19.4 |