Common Name: 6,8,11,13-Abietatetrene-3beta,12-diol
Synonyms: 6,8,11,13-Abietatetrene-3beta,12-diol
CAS Registry Number:
InChI: InChI=1S/C20H28O2/c1-12(2)14-10-13-6-7-17-19(3,4)18(22)8-9-20(17,5)15(13)11-16(14)21/h6-7,10-12,17-18,21-22H,8-9H2,1-5H3/t17-,18-,20+/m0/s1
InChIKey: InChIKey=UEGVPAMXTLMAFY-CMKODMSKSA-N
Formula: C20H28O2
Molecular Weight: 300.435869
Exact Mass: 300.20893
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bai, J., Ito, N., Sakai, J., Kitabatake, M., Fujisawa, H., Bai, L., Dai, J., Zhang, S., Hirose, K., Tomida, A., Tsuruo, T., Ando, M. J Nat Prod (2005) 68, 497-501
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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)
Position | PPM |
---|---|
1 (CH2) | 34.2 |
2 (CH2) | 27.7 |
3 (CH) | 78.7 |
4 (C) | 38.3 |
5 (CH) | 50.3 |
6 (CH) | 126.5 |
7 (CH) | 127.9 |
8 (C) | 126.1 |
9 (C) | 146.5 |
10 (C) | 37.5 |
11 (CH) | 109.5 |
12 (C) | 152.3 |
13 (C) | 131.2 |
14 (CH) | 124.6 |
15 (CH) | 26.7 |
16 (CH3) | 22.8 |
17 (CH3) | 22.4 |
18 (CH3) | 27.8 |
19 (CH3) | 16.5 |
20 (CH3) | 20.2 |