15-O-[6 '-(p-Hydroxyphenylacetyl)]-b-D-glucopyrano-sylurospermal A

15-O-[6 '-(p-Hydroxyphenylacetyl)]-b-D-glucopyrano-sylurospermal A

Common Name: 15-O-[6 '-(p-Hydroxyphenylacetyl)]-b-D-glucopyrano-sylurospermal A

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C29H34O12/c1-15-24-20(32)9-17(12-30)3-2-4-18(10-21(24)40-28(15)37)13-39-29-27(36)26(35)25(34)22(41-29)14-38-23(33)11-16-5-7-19(31)8-6-16/h3,5-8,10,12,20-22,24-27,29,31-32,34-36H,1-2,4,9,11,13-14H2/b17-3+,18-10-/t20-,21+,22+,24+,25+,26-,27+,29+/m0/s1

InChIKey: InChIKey=NGDUYKZDYOOZLX-IPTIBXCDSA-N

Formula: C29H34O12

Molecular Weight: 574.574186

Exact Mass: 574.205027

NMR Solvent: CD3OD

MHz:

Calibration:

NMR references: 13C - Helal, A.M., Nakamura, N., El-Askary, H., Hattori, M. Phytochemistry (2000) 53, 473-7

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Germacranes; 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) 160.9
2 (CH2) 27.7
3 (CH2) 33.5
4 (C) 138.6
5 (CH) 128.2
6 (CH) 76
7 (CH) 51
8 (CH) 69.5
9 (CH2) 32.3
10 (C) 143.8
11 (C) 136.8
12 (C) 170.9
13 (CH2) 124.4
14 (CH) 200.1
15 (CH2) 68.1
1' (CH) 102.3
2' (CH) 73
3' (CH) 76.5
4' (CH) 69.6
5' (CH) 73.7
6' (CH2) 63.3
6'a (C) 172.2
6'b (CH2) 40
6'c (C) 124.4
6'd (CH) 115
6'e (CH) 129.9
6'f (C) 155.6
6'g (CH) 129.9
6'h (CH) 115