Spektraris NMR

Common Name: (1S,4S,5S,7R,10R)-10,11,14-Trihydroxyguai-3-one

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H26O4/c1-9-11-6-10(14(2,3)18)4-5-15(19,8-16)12(11)7-13(9)17/h9-12,16,18-19H,4-8H2,1-3H3/t9-,10+,11-,12-,15-/m0/s1

InChIKey: InChIKey=GTNUTSUOBZNGSY-ONQKKCPMSA-N

Formula: C15H26O4

Molecular Weight: 270.365118

Exact Mass: 270.183109

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)