Aristelegone-A

Aristelegone-A

Common Name: Aristelegone-A

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C12H14O2/c1-7-3-4-11(13)10-5-8(2)12(14)6-9(7)10/h5-7,14H,3-4H2,1-2H3/t7-/m1/s1

InChIKey: InChIKey=BYOIVWRPJQKGMQ-SSDOTTSWSA-N

Formula: C12H14O2

Molecular Weight: 190.238811

Exact Mass: 190.09938

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Wu, T.S., Tsai, Y.L., Damu, A.G., Kuo, P.C., Wu, P.L. J Nat Prod (2002) 65, 1522-5

Species:

Notes: Family : Aromatics, Type : Naphthalenes, Group : Naphthalenes; 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) 199
2 (CH2) 36.2
3 (CH2) 30.8
4 (CH) 32.6
5 (CH) 122.9
6 (C) 160.3
7 (C) 124.5
8 (CH) 130.7
9 (C) 123.4
10 (C) 149.9
4a (CH3) 20.4
7a (CH3) 15.4