nubenolide

nubenolide

Common Name: nubenolide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H16O4/c1-6-4-9(16)11-7(2)5-10-13(14(17)12(6)11)8(3)15(18)19-10/h4,10,12,14,17H,5H2,1-3H3/t10-,12-,14+/m1/s1

InChIKey: InChIKey=ASIVTMRMNHENCL-QKCSRTOESA-N

Formula: C15H16O4

Molecular Weight: 260.28571

Exact Mass: 260.104859

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Ali, M.S., Ahmed, W., Armstrong, A.F., Ibrahim, S.A., Ahmed, S., Parvez, M. Chem Pharm Bull (2006) 54, 1235-8

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)

Carbon NMR Peaks

Position PPM
1 (C) 135.4
2 (C) 195.8
3 (CH) 135.3
4 (C) 173.1
5 (CH) 53.3
6 (CH) 75.1
7 (C) 164.6
8 (CH) 77.6
9 (CH2) 41.7
10 (C) 141.7
11 (C) 122.7
12 (C) 174.2
13 (CH3) 10.5
14 (CH3) 21
15 (CH3) 20.1