Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C27H36O9/c1-6-16(2)22(31)35-20-11-23(4)24(5,19(29)10-25(36-23)12-21(30)33-13-25)18-8-7-9-26(14-34-26)27(18,20)15-32-17(3)28/h6,18,20H,7-15H2,1-5H3/b16-6+/t18-,20+,23+,24+,25+,26+,27+/m1/s1

InChIKey: InChIKey=DISFXZAIRXWFBS-ZNMKLMJHSA-N

Formula: C27H36O9

Molecular Weight: 504.570381

Exact Mass: 504.235933

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Munoz, D.M., delaTorre, M.C., Rodriguez, B., Simmonds, M.S.J., Blaney, W.M. Phytochemistry (1997) 44, 593-7

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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)

Carbon NMR Peaks

Position PPM
1 (CH2) 22.7
2 (CH2) 25.1
3 (CH2) 32.7
4 (C) 64.9
5 (C) 44.4
6 (CH) 69
7 (CH2) 37.9
8 (C) 82.4
9 (C) 56
10 (CH) 45.6
11 (C) 204.5
12 (CH2) 44.7
13 (C) 79.6
14 (CH2) 44.2
15 (C) 171.9
16 (CH2) 76.8
17 (CH3) 24.9
18 (CH2) 49.2
19 (CH2) 62.3
20 (CH3) 12.8
6a (C) 166.7
6b (C) 128.7
6c (CH) 137.4
6d (CH3) 14.3
6ba (CH3) 12
19a (C) 170.8
19b (CH3) 21.1