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: DMSO-d6

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
2 (CH2) 23.8
3 (CH) 142.6
4 (C) 133.5
5 (C) 38.6
6 (CH) 82
7 (CH2) 28.5
8 (CH) 46
9 (C) 38.8
10 (CH) 44.9
11 (CH2) 64
12 (CH) 67.8
13 (C) 127.1
14 (CH) 109.5
15 (CH) 143.2
16 (CH) 140.1
17 (C) 177.4
18 (C) 166.4
19 (CH3) 26.9
20 (CH3) 20.5
1' (CH) 99.6
2' (CH) 73.6
3' (CH) 76.7
4' (CH) 70.1
5' (CH) 75.7
6' (CH2) 69.1
1'' (CH) 103.5
2'' (CH) 73.6
3'' (CH) 76.9
4'' (CH) 70.7
5'' (CH) 76.8
6'' (CH2) 61.2
18a (CH3) 51.7