Spektraris NMR

Common Name: (1S,5R,7R,10R)-Secoatractylolactone

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H24O5/c1-9(17)11-6-10(14(2,3)19)4-5-15(8-16)12(11)7-13(18)20-15/h10-12,16,19H,4-8H2,1-3H3/t10-,11+,12+,15+/m1/s1

InChIKey: InChIKey=AWESNKUZUASSJT-YXMPFFBPSA-N

Formula: C15H24O5

Molecular Weight: 284.348641

Exact Mass: 284.162374

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Kitajima, J., Kamoshita, A., Ishikawa, T., Takano, A., Fukuda, T., Isoda, S., Ida, Y. Chem Pharm Bull (2003) 51, 152-7

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)