Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C33H50O6/c1-9-23(19(2)3)11-10-20(4)24-13-15-33(37)26-16-28(36)27-17-29(38-21(5)34)30(39-22(6)35)18-31(27,7)25(26)12-14-32(24,33)8/h16-17,19-20,23-25,29-30,37H,9-15,18H2,1-8H3/t20-,23-,24-,25+,29-,30+,31-,32-,33-/m1/s1

InChIKey: InChIKey=ISXSDMWDRRMUHJ-UQQCOLSDSA-N

Formula: C33H50O6

Molecular Weight: 542.747752

Exact Mass: 542.360739

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Kovganko, N.V., Sokolov, S.N. Chem Nat Compd (2001) 37, 162-6

Species:

Notes: Family : Steroids, Type : Stigmastanes; 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) 35.4
2 (CH) 67.2
3 (CH) 66.8
4 (CH) 124.7
5 (C) 146.4
6 (C) 189.4
7 (CH) 123.6
8 (C) 166.4
9 (CH) 43.7
10 (C) 38.8
11 (CH2) 20.6
12 (CH2) 30.4
13 (C) 46.6
14 (C) 84.9
15 (CH2) 31.6
16 (CH2) 26.5
17 (CH) 50.5
18 (CH3) 15.8
19 (CH3) 22.1
20 (CH) 36.3
21 (CH3) 20.2
22 (CH2) 34
23 (CH2) 26.4
24 (CH) 45.8
25 (CH) 29.2
26 (CH3) 19
27 (CH3) 19.9
24a (CH2) 23.1
24b (CH3) 12
2a (C) 170.3
2b (CH3) 20.9
3a (C) 170.4
3b (CH3) 21.1