Myricetin 3-O-(6''-acetyl)-β-D-galactopyranoside

Myricetin 3-O-(6''-acetyl)-β-D-galactopyranoside

Common Name: Myricetin 3-O-(6''-acetyl)-β-D-galactopyranoside

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C23H22O14/c1-7(24)34-6-14-17(30)19(32)20(33)23(36-14)37-22-18(31)15-10(26)4-9(25)5-13(15)35-21(22)8-2-11(27)16(29)12(28)3-8/h2-5,14,17,19-20,23,25-30,32-33H,6H2,1H3/t14-,17+,19+,20-,23+/m1/s1

InChIKey: InChIKey=SVRJGKAZQHHOSZ-UOCKATJYSA-N

Formula: C23H22O14

Molecular Weight: 522.413291

Exact Mass: 522.100955

NMR Solvent: DMSO-d6

MHz:

Calibration:

NMR references: 13C - Foo, L.Y., Lu, Y., Molan, A.L., Woodfield, D.R., McNabb, W.C. Phytochemistry (2000) 54, 539-48

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) 156.6
3 (C) 134
4 (C) 177.7
5 (C) 161.6
6 (CH) 99
7 (C) 164.5
8 (CH) 93.7
9 (C) 156.6
10 (C) 104.1
1' (C) 120.3
2' (CH) 108.8
3' (C) 145.7
4' (C) 137.1
5' (C) 145.7
6' (CH) 108.8
1'' (CH) 102.1
2'' (CH) 71.3
3'' (CH) 73.3
4'' (CH) 68.6
5'' (CH) 73.3
6'' (CH2) 63.5
6''a (C) 170.2
6''b (CH3) 20.4