Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C33H50O6/c1-20(2)23-13-14-25-24(31(23,6)17-16-27(35)38-9)15-18-32(7)28(26(34)19-33(25,32)8)22(29(36)39-10)12-11-21(3)30(4,5)37/h14-15,22-23,26,28,34,37H,1,3,11-13,16-19H2,2,4-10H3/t22-,23+,26-,28+,31+,32-,33+/m1/s1
InChIKey: InChIKey=SEHMUCBKPQFAMJ-JGONMFNGSA-N
Formula: C33H50O6
Molecular Weight: 542.747752
Exact Mass: 542.360739
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Tai, T., Akahori, A., Shingu, T. Phytochemistry (1993) 32, 1239-44
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Lanostanes; 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)
Position | PPM |
---|---|
1 (CH2) | 35.9 |
2 (CH2) | 29.5 |
3 (C) | 174.4 |
4 (C) | 149 |
5 (CH) | 50.6 |
6 (CH2) | 28.5 |
7 (CH) | 118.1 |
8 (C) | 141.5 |
9 (C) | 137.3 |
10 (C) | 38.8 |
11 (CH) | 120 |
12 (CH2) | 36.7 |
13 (C) | 45.3 |
14 (C) | 49 |
15 (CH2) | 43.7 |
16 (CH) | 76 |
17 (CH) | 57.4 |
18 (CH3) | 18.3 |
19 (CH3) | 22.2 |
20 (CH) | 47.8 |
21 (C) | 176.4 |
22 (CH2) | 32 |
23 (CH2) | 29.8 |
24 (C) | 157.5 |
25 (C) | 72.4 |
26 (CH3) | 30 |
27 (CH3) | 30 |
28 (CH2) | 112.2 |
29 (CH3) | 22.2 |
30 (CH3) | 24.7 |
3a (CH3) | 51.1 |
21a (CH3) | 51.3 |
24a (CH2) | 107.1 |