Common Name: Hostmaniane
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C13H18O5/c1-13(2,17)11(15)7-9-6-8(12(16)18-3)4-5-10(9)14/h4-6,11,14-15,17H,7H2,1-3H3
InChIKey: InChIKey=ABFHVQPVDSMGNR-UHFFFAOYSA-N
Formula: C13H18O5
Molecular Weight: 254.279525
Exact Mass: 254.115424
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Lago, J.H., Ramos, C.S., Casanova, D.C., Morandim Ade, A., Bergamo, D.C., Cavalheiro, A.J., Bolzani Vda, S., Furlan, M., Guimaraes, E.F., Young, M.C., Kato, M.J. J Nat Prod (2004) 67, 1783-8
Species:
Notes: Family : Aromatics, Type : Phenyl-alkanoids, Group : Phenylisoprenoids; 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) | 118.7 |
2 (CH) | 132.2 |
3 (C) | 122.4 |
4 (CH) | 129.5 |
5 (CH) | 117.2 |
6 (C) | 157.1 |
7 (CH2) | 31.1 |
8 (CH) | 69.2 |
9 (C) | 77.8 |
10 (CH3) | 25 |
11 (CH3) | 22 |
3a (C) | 166.9 |
3b (CH3) | 51.8 |