Sweroside aglucone-1-acetate

Sweroside aglucone-1-acetate

Common Name: Sweroside aglucone-1-acetate

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C12H14O5/c1-3-8-9-4-5-15-11(14)10(9)6-16-12(8)17-7(2)13/h3,6,8-9,12H,1,4-5H2,2H3/t8-,9-,12+/m0/s1

InChIKey: InChIKey=GDKIXQMXZPJDGT-HOTUBEGUSA-N

Formula: C12H14O5

Molecular Weight: 238.237026

Exact Mass: 238.084124

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Horn, M.M., Drewes, S.E., Brown, N.J., Munro, O.Q., Meyer, J.J., Mathekga, A.D. Phytochemistry (2001) 57, 51-6

Species:

Notes: Family : Terpenoids, Type : Monoterpenoids, Group : Iridoids; 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 (CH) 93.1
3 (CH) 154.1
4 (C) 104.4
5 (CH) 34
6 (CH2) 27.2
7 (CH2) 68.1
8 (CH) 132.6
9 (CH) 46.2
10 (CH2) 121.4
11 (C) 164.7
1a (C) 169.1
1b (CH3) 20.7