Common Name: (3aS,9aS,9bS)-6-methyl-3,9-bis(methylene)-3a,4,5,7,8,9,9a,9b-octahydroazuleno[4,5-b]furan-2(3H)-one
Synonyms: (3aS,9aS,9bS)-6-methyl-3,9-bis(methylene)-3a,4,5,7,8,9,9a,9b-octahydroazuleno[4,5-b]furan-2(3H)-one
CAS Registry Number:
InChI: InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h12-14H,2-7H2,1H3/t12-,13-,14-/m0/s1
InChIKey: InChIKey=BJYLDDWXWJTGPU-IHRRRGAJSA-N
Formula: C15H18O2
Molecular Weight: 230.302782
Exact Mass: 230.13068
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Yuuya, S., Hagiwara, H., Suzuki, T., Ando, M., Yamada, A., Suda, K., Kataoka, T., Nagai, K. J Nat Prod (1999) 62, 22-30
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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 (C) | 131.43 |
2 (CH2) | 32.82 |
3 (CH2) | 31.78 |
4 (C) | 149.52 |
5 (CH) | 52.4 |
6 (CH) | 81.97 |
7 (CH) | 53.14 |
8 (CH2) | 25.87 |
9 (CH2) | 34.45 |
10 (C) | 136 |
11 (C) | 140.42 |
12 (C) | 169.81 |
13 (CH2) | 117.52 |
14 (CH3) | 23.34 |
15 (CH2) | 110.61 |