Spektraris NMR
(23S*)-Cycloart-24-ene-3b,23-diol
Common Name: (23S*)-Cycloart-24-ene-3b,23-diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H50O2/c1-19(2)16-21(31)17-20(3)22-10-12-28(7)24-9-8-23-26(4,5)25(32)11-13-29(23)18-30(24,29)15-14-27(22,28)6/h16,20-25,31-32H,8-15,17-18H2,1-7H3/t20-,21+,22-,23+,24+,25+,27-,28+,29-,30+/m1/s1
InChIKey: InChIKey=GCFZSJAFEVXDNW-MHJCRUCLSA-N
Formula: C30H50O2
Molecular Weight: 442.717924
Exact Mass: 442.381081
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Lago J.H., Brochini C.B., Roque N.F. Phytochemistry (2002) 60, 333-8
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Cycloartanes; 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) | 32 |
| 2 (CH2) | 30.4 |
| 3 (CH) | 78.9 |
| 4 (C) | 40.5 |
| 5 (CH) | 47.1 |
| 6 (CH2) | 21.1 |
| 7 (CH2) | 28.3 |
| 8 (CH) | 47.9 |
| 9 (C) | 20 |
| 10 (C) | 25.7 |
| 11 (CH2) | 26 |
| 12 (CH2) | 35.5 |
| 13 (C) | 45.4 |
| 14 (C) | 48.9 |
| 15 (CH2) | 32.7 |
| 16 (CH2) | 26.5 |
| 17 (CH) | 52.9 |
| 18 (CH3) | 18.1 |
| 19 (CH2) | 29.9 |
| 20 (CH) | 33 |
| 21 (CH3) | 18.1 |
| 22 (CH2) | 44.5 |
| 23 (CH) | 66.1 |
| 24 (CH) | 129.1 |
| 25 (C) | 133.8 |
| 26 (CH3) | 25.4 |
| 27 (CH3) | 18.3 |
| 28 (CH3) | 26.1 |
| 29 (CH3) | 14 |
| 30 (CH3) | 19.3 |
