Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C38H46O8/c1-23-20-38-21-25(23)15-16-30(38)36(3)18-17-32(45-34(40)26-11-7-9-13-28(26)42-5)37(4,22-44-24(2)39)31(36)19-33(38)46-35(41)27-12-8-10-14-29(27)43-6/h7-14,25,30-33H,1,15-22H2,2-6H3/t25-,30+,31+,32-,33+,36+,37-,38+/m1/s1
InChIKey: InChIKey=ISYAFHCSWJXENP-AWBMFBHRSA-N
Formula: C38H46O8
Molecular Weight: 630.768478
Exact Mass: 630.319268
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bruno, M., Rosselli, S., Pibiri, I., Kilgore, N., Lee, K.H. J Nat Prod (2002) 65, 1594-7
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) | 38 |
2 (CH2) | 23.1 |
3 (CH) | 74.8 |
4 (C) | 40.4 |
5 (CH) | 39.7 |
6 (CH2) | 24.2 |
7 (CH) | 79.4 |
8 (C) | 47.2 |
9 (CH) | 51.2 |
10 (C) | 38.7 |
11 (CH2) | 18 |
12 (CH2) | 33.3 |
13 (CH) | 43.6 |
14 (CH2) | 38 |
15 (CH2) | 45.3 |
16 (C) | 154.3 |
17 (CH2) | 103.7 |
18 (CH2) | 65.1 |
19 (CH3) | 13.3 |
20 (CH3) | 18 |
3a (C) | 166 |
3b (C) | 128.3 |
3c (C) | 159.7 |
3d (CH) | 112.1 |
3e (CH) | 133.7 |
3f (CH) | 120.2 |
3g (CH) | 132.2 |
3ca (CH3) | 55.7 |
7a (C) | 165 |
7b (C) | 127.5 |
7c (C) | 159.6 |
7d (CH) | 111.9 |
7e (CH) | 133.2 |
7f (CH) | 120.1 |
7g (CH) | 131.5 |
7ca (CH3) | 55.9 |
18a (C) | 170.5 |
18b (CH3) | 19.7 |