11R,12-dihydroxy-6(7)-spirovetiven-8-one-9-O-β-D-glucopyranoside

11R,12-dihydroxy-6(7)-spirovetiven-8-one-9-O-β-D-glucopyranoside

Common Name: 11R,12-dihydroxy-6(7)-spirovetiven-8-one-9-O-β-D-glucopyranoside

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C21H34O9/c1-10-6-13(24)18(30-19-17(27)16(26)15(25)14(8-22)29-19)11(2)21(10)5-4-12(7-21)20(3,28)9-23/h6,11-12,14-19,22-23,25-28H,4-5,7-9H2,1-3H3/t11-,12-,14-,15-,16+,17-,18+,19+,20?,21-/m1/s1

InChIKey: InChIKey=LURIVFADCBZEJA-RPAMAVNMSA-N

Formula: C21H34O9

Molecular Weight: 430.490084

Exact Mass: 430.220283

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Feng, X., Wang, J.S., Luo, J., Kong, L.Y. J Asian Nat Prod Res (2009) 11, 675-80

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Spirovetivanes; 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) 124.5
2 (C) 199.3
3 (CH) 81.4
4 (CH) 46.3
5 (C) 52.8
6 (CH2) 36.6
7 (CH) 46.1
8 (CH2) 27.6
9 (CH2) 35.5
10 (C) 166.6
11 (C) 73.2
12 (CH3) 23.8
13 (CH2) 69.9
14 (CH3) 20.1
15 (CH3) 9.5
1' (CH) 105.6
2' (CH) 75.9
3' (CH) 78.5
4' (CH) 71.6
5' (CH) 78.6
6' (CH2) 62.8