andropanoside

andropanoside

Common Name: andropanoside

Synonyms: andropanoside

CAS Registry Number:

InChI: InChI=1S/C26H40O9/c1-14-4-7-18-25(2,16(14)6-5-15-9-11-33-23(15)32)10-8-19(28)26(18,3)13-34-24-22(31)21(30)20(29)17(12-27)35-24/h9,16-22,24,27-31H,1,4-8,10-13H2,2-3H3/t16-,17-,18+,19-,20-,21+,22-,24-,25+,26+/m1/s1

InChIKey: InChIKey=MEEPUSVTMHGIPC-MVGASCEISA-N

Formula: C26H40O9

Molecular Weight: 496.591408

Exact Mass: 496.267233

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Matsuda, T., Kuroyanagi, M., Sugiyama, S., Umehara, K., Ueno, A., Nishi, K. Chem Pharm Bull (1994) 42, 1216-25

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) 37.8
2 (CH2) 29.2
3 (CH) 79.1
4 (C) 43.3
5 (CH) 55.8
6 (CH2) 25.3
7 (CH2) 38.8
8 (C) 148.2
9 (CH) 56.6
10 (C) 39.7
11 (CH2) 22.4
12 (CH2) 25
13 (C) 134.2
14 (CH) 145.2
15 (CH2) 70.5
16 (C) 174.4
17 (CH2) 107
18 (CH3) 24.4
19 (CH2) 72
20 (CH3) 15
1' (CH) 105.4
2' (CH) 74.8
3' (CH) 78.7
4' (CH) 71.8
5' (CH) 78.4
6' (CH2) 62.8