Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C31H54O2/c1-10-27(4)14-13-23-29(6,22(27)11-12-25(32)33-9)18-20-31(8)24-21-26(2,3)15-16-28(24,5)17-19-30(23,31)7/h22-24H,10-21H2,1-9H3/t22-,23+,24-,27+,28-,29+,30-,31+/m1/s1
InChIKey: InChIKey=LNGURJYBHGCTMR-XOWAGCGSSA-N
Formula: C31H54O2
Molecular Weight: 458.760423
Exact Mass: 458.412381
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Katakaga, J., Tetsumi, T., Hasegawa, H., Iida, T., Katai, M, Natural Medicines (2000) 54, 18-21
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Friedelanes; 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) | 21.4 |
2 (CH2) | 37.7 |
3 (C) | 174.3 |
4 (CH2) | 39 |
5 (C) | 36.1 |
6 (CH2) | 39.1 |
7 (CH2) | 18.1 |
8 (CH) | 53 |
9 (C) | 37.8 |
10 (CH) | 59.8 |
11 (CH2) | 35.3 |
12 (CH2) | 30.2 |
13 (C) | 38.3 |
14 (C) | 39.6 |
15 (CH2) | 32.3 |
16 (CH2) | 36 |
17 (C) | 30 |
18 (CH) | 42.9 |
19 (CH2) | 35.2 |
20 (C) | 28.2 |
21 (CH2) | 32.9 |
22 (CH2) | 39.3 |
23 (CH3) | 7.6 |
24 (CH3) | 19.4 |
25 (CH3) | 18 |
26 (CH3) | 20.2 |
27 (CH3) | 18.8 |
28 (CH3) | 32.1 |
29 (CH3) | 35 |
30 (CH3) | 31.9 |
3a (CH3) | 51.4 |