3β,11-dihydroxydrim-8 (12)-en-11-O-β-D-glucopyranoside

3β,11-dihydroxydrim-8 (12)-en-11-O-β-D-glucopyranoside

Common Name: 3β,11-dihydroxydrim-8 (12)-en-11-O-β-D-glucopyranoside

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C21H36O7/c1-11-5-6-14-20(2,3)15(23)7-8-21(14,4)12(11)10-27-19-18(26)17(25)16(24)13(9-22)28-19/h12-19,22-26H,1,5-10H2,2-4H3/t12-,13+,14-,15-,16+,17-,18+,19+,21+/m0/s1

InChIKey: InChIKey=DCKQBSRRWHRWQR-PEULYYRBSA-N

Formula: C21H36O7

Molecular Weight: 400.507155

Exact Mass: 400.246104

NMR Solvent: CD3OD

MHz:

Calibration:

NMR references: 13C - Kuang, H., Sun, C., Zhang, Y., Chen, D., Yang, B., Xia, Y. Fitoterapia (2009) 80, 134-7

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Drimanes; 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 (CH2) 38.4
2 (CH2) 28.5
3 (CH) 79.4
4 (C) 40.2
5 (CH) 55.7
6 (CH2) 24.8
7 (CH2) 38.7
8 (C) 148.3
9 (CH) 57.1
10 (C) 39.7
11 (CH2) 67.8
12 (CH2) 108.4
13 (CH3) 28.9
14 (CH3) 16.2
15 (CH3) 15.7
1' (CH) 105
2' (CH) 75.1
3' (CH) 78.1
4' (CH) 71.1
5' (CH) 78
6' (CH2) 62.8