Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C16H12O16S3/c1-28-10-3-2-7(4-11(10)31-34(22,23)24)15-16(32-35(25,26)27)14(18)13-9(17)5-8(6-12(13)29-15)30-33(19,20)21/h2-6,17H,1H3,(H,19,20,21)(H,22,23,24)(H,25,26,27)

InChIKey: InChIKey=VURGHZOHAIMKQD-UHFFFAOYSA-N

Formula: C16H12O16S3

Molecular Weight: 556.455796

Exact Mass: 555.928746

NMR Solvent: DMSO-d6

MHz:

Calibration:

NMR references: 13C - Barron, D., Ibrahim, R.K. Tetrahedron (1987) 43, 5197-202

Species:

Notes: Family : Flavonoids, Type : Flavonoids, Group : Flavonols; 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
2 (C) 155.6
3 (C) 133.1
4 (C) 177.7
5 (C) 161.5
6 (CH) 102.4
7 (C) 159.4
8 (CH) 96.4
9 (C) 156.2
10 (C) 106.9
1' (C) 122.2
2' (CH) 121.3
3' (C) 141.9
4' (C) 153.2
5' (CH) 112
6' (CH) 126.3
4'a (CH3) 55.8