Spektraris NMR

Common Name: 3alpha,4alpha,10beta-Trihydroxy-8alpha-acetoxyguai-1,11(13)-dien-6alpha,12-olide

Synonyms: 3alpha,4alpha,10beta-Trihydroxy-8alpha-acetoxyguai-1,11(13)-dien-6alpha,12-olide

CAS Registry Number:

InChI: InChI=1S/C17H22O7/c1-7-12-10(23-8(2)18)6-16(3,21)9-5-11(19)17(4,22)13(9)14(12)24-15(7)20/h5,10-14,19,21-22H,1,6H2,2-4H3/t10-,11-,12+,13-,14-,16-,17+/m0/s1

InChIKey: InChIKey=WWYRIZXCJUURHL-BKQVOYNQSA-N

Formula: C17H22O7

Molecular Weight: 338.353041

Exact Mass: 338.136553

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Ahmed, A.A., El-Moghazy, S.A., El-Shanawany, M.A., Abdel-Ghani, H.F., Karchesy, J., Sturtz, G., Dalley, K., Pare, P.W. J Nat Prod (2004) 67, 1705-10

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)