Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C27H38O9/c1-6-14(2)22(30)36-24-27-19(11-18(35-24)12-26(27)13-33-26)25(5,9-7-17-8-10-32-23(17)31)15(3)20(21(27)29)34-16(4)28/h6,15,17-21,24,29H,7-13H2,1-5H3/b14-6+/t15-,17+,18-,19-,20-,21+,24-,25+,26+,27+/m1/s1

InChIKey: InChIKey=JUJDXVZXTGEDQX-IBCTUQPBSA-N

Formula: C27H38O9

Molecular Weight: 506.586262

Exact Mass: 506.251583

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Rodriguez, B., DelaTorre, M.C., GomezSerranillos, P. Phytochemistry (1996) 41, 247-53

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) 28.2
2 (CH) 66.9
3 (CH2) 36.5
4 (C) 62.2
5 (C) 41.8
6 (CH) 74.2
7 (CH) 71.6
8 (CH) 39.7
9 (C) 39.8
10 (CH) 39.2
11 (CH2) 34.8
12 (CH2) 23.3
13 (CH) 39.3
14 (CH2) 26.5
15 (CH2) 66.5
16 (C) 179.5
17 (CH3) 10.6
18 (CH2) 50.8
19 (CH) 92.6
20 (CH3) 18.1
7a (C) 170.3
7b (CH3) 20.9
19a (C) 165.9
19b (C) 128.9
19c (CH) 138.4
19d (CH3) 14.6
19ba (CH3) 12