Common Name: Juncin K
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C36H50O14/c1-18(2)12-29(40)48-26-15-27(49-30(41)13-19(3)4)35(17-45-35)31-32(47-23(8)39)36(43)20(5)33(42)50-28(36)14-24(16-44-21(6)37)10-11-25(34(26,31)9)46-22(7)38/h10-11,14,18-20,25-28,31-32,43H,12-13,15-17H2,1-9H3/b11-10-,24-14+/t20-,25+,26-,27+,28-,31+,32+,34-,35+,36-/m0/s1
InChIKey: InChIKey=LQYPQXKGPDRUES-REKFRCBQSA-N
Formula: C36H50O14
Molecular Weight: 706.775199
Exact Mass: 706.320056
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Anjaneyulu, A.S., Rao, V.L., Sastry, V.G., Venugopal, M.J., Schmitz, F.J. J Nat Prod (2003) 66, 507-10
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Briaranes; 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 (C) | 47.1 |
2 (CH) | 74.4 |
3 (CH) | 132.4 |
4 (CH) | 127.4 |
5 (C) | 139.8 |
6 (CH) | 122.3 |
7 (CH) | 78.8 |
8 (C) | 81.1 |
9 (CH) | 64 |
10 (CH) | 32.7 |
11 (C) | 59.2 |
12 (CH) | 72.9 |
13 (CH2) | 28.9 |
14 (CH) | 73 |
15 (CH3) | 14.1 |
16 (CH2) | 62.8 |
17 (CH) | 44.1 |
18 (CH3) | 175.3 |
19 (C) | 6.3 |
20 (CH2) | 49 |
2a (C) | 170.2 |
2b (CH3) | 21.5 |
9a (C) | 170 |
9b (CH3) | 21.2 |
12a (C) | 172.2 |
12b (CH2) | 43.2 |
12c (CH) | 25.6 |
12d (CH3) | 22.6 |
12ca (CH3) | 22.4 |
14a (C) | 171.9 |
14b (CH2) | 42.8 |
14c (CH) | 24.7 |
14d (CH3) | 22.4 |
14ca (CH3) | 22.4 |
16a (C) | 169 |
16b (CH3) | 21.1 |