Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C33H46O16/c1-32(16-9-21(49-29(16)42)33(2)15(28(41)43-3)5-4-6-20(32)33)10-17(14-7-8-44-12-14)46-31-27(40)25(38)23(36)19(48-31)13-45-30-26(39)24(37)22(35)18(11-34)47-30/h5,7-8,12,16-27,30-31,34-40H,4,6,9-11,13H2,1-3H3/t16-,17?,18-,19+,20-,21-,22-,23+,24+,25-,26-,27+,30-,31+,32-,33-/m1/s1

InChIKey: InChIKey=RDANOZJKKFLLEO-SHVLKNRUSA-N

Formula: C33H46O16

Molecular Weight: 698.710038

Exact Mass: 698.278585

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Martin, T.S., Ohtani, K., Kasai, R., Yamasaki, K. Phytochemistry (1996) 42, 153-8

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) 16.6
2 (CH2) 24.3
3 (CH) 142.5
4 (C) 134.7
5 (C) 39.6
6 (CH) 82.8
7 (CH2) 29.6
8 (CH) 47.1
9 (C) 39.9
10 (CH) 45.8
11 (CH2) 47.5
12 (CH) 69.2
13 (C) 128.4
14 (CH) 110.4
15 (CH) 143.4
16 (CH) 140.9
17 (C) 178.3
18 (C) 166.9
19 (CH3) 27.3
20 (CH3) 21.4
1' (CH) 101.2
2' (CH) 75.2
3' (CH) 78.3
4' (CH) 71.7
5' (CH) 76.9
6' (CH2) 70.9
1'' (CH) 105.4
2'' (CH) 75.4
3'' (CH) 78.4
4'' (CH) 72.2
5'' (CH) 78.4
6'' (CH2) 62.8
18a (CH3) 51.5