Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C33H50O7/c1-9-23(19(2)3)11-10-20(4)24-13-15-33(40-37)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=WVVQRMQGFGHGFX-UQQCOLSDSA-N

Formula: C33H50O7

Molecular Weight: 558.747157

Exact Mass: 558.355654

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) 35.2
2 (CH) 67.1
3 (CH) 66.7
4 (CH) 127.5
5 (C) 146.5
6 (C) 189
7 (CH) 124.6
8 (C) 162.2
9 (CH) 43.5
10 (C) 39
11 (CH2) 20.7
12 (CH2) 29.8
13 (C) 48
14 (C) 96.4
15 (CH2) 24.6
16 (CH2) 26.6
17 (CH) 50.9
18 (CH3) 16.6
19 (CH3) 22.1
20 (CH) 35.9
21 (CH3) 19.9
22 (CH2) 34
23 (CH2) 26.4
24 (CH) 45.8
25 (CH) 29.2
26 (CH3) 19
27 (CH3) 19
24a (CH2) 23.1
24b (CH3) 12
2a (C) 170.6
2b (CH3) 20.8
3a (C) 170.7
3b (CH3) 21.1