Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C28H30N2O6/c1-25-13-21(18-8-11-33-15-18)36-26(25,2)9-10-27-16-34-24(32)28(27)19(14-29-30-28)20(12-22(25)27)35-23(31)17-6-4-3-5-7-17/h3-8,11,15,19-22H,9-10,12-14,16H2,1-2H3/t19-,20+,21+,22+,25+,26-,27-,28+/m0/s1

InChIKey: InChIKey=BYVWZZFNEVKHHT-YHACIYEQSA-N

Formula: C28H30N2O6

Molecular Weight: 490.548743

Exact Mass: 490.210387

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Fontana, G., Savona, G., Rodriguez, B., Dersch, C.M., Rothman, R.B., Prisinzano, T.E. Tetrahedron (2008) 64, 10041-8

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) 27.3
2 (CH) 74.4
3 (CH) 41.2
4 (C) 96.7
5 (C) 45.7
6 (CH2) 27.2
7 (CH2) 29.7
8 (C) 83.2
9 (C) 47.2
10 (CH) 39.8
11 (CH2) 44.6
12 (CH) 70
13 (C) 128.3
14 (CH) 108.7
15 (CH) 143.4
16 (CH) 139
17 (CH3) 26.9
18 (C) 169.4
19 (CH2) 68.5
20 (CH3) 17.2
2a (C) 165.9
2b (C) 129.3
2c (CH) 129.6
2d (CH) 128.6
2e (CH) 133.7
2f (CH) 128.6
2g (CH) 129.6
3a (CH2) 79.7