Common Name: 8bH-eremophil-3,7(11)-diene-12,8a(14,6a)-diolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H16O4/c1-7-11-10(18-13(7)16)6-8-4-3-5-9-14(17)19-12(11)15(8,9)2/h5,8,10,12H,3-4,6H2,1-2H3/t8-,10+,12+,15+/m1/s1
InChIKey: InChIKey=NCTYRIDOQXKYJJ-KHNKHLGUSA-N
Formula: C15H16O4
Molecular Weight: 260.28571
Exact Mass: 260.104859
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Han, Y.F., Pan, J., Gao, K., Jia, Z.J. Chem Pharm Bull (2005) 53, 1338-41
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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) | 21.8 |
2 (CH2) | 22 |
3 (CH) | 136.9 |
4 (C) | 129.6 |
5 (C) | 44 |
6 (CH) | 81.8 |
7 (C) | 155.9 |
8 (CH) | 77.4 |
9 (CH2) | 33 |
10 (CH) | 33.6 |
11 (C) | 125.4 |
12 (C) | 173.4 |
13 (CH3) | 9.4 |
14 (CH3) | 27 |
15 (C) | 168.3 |