Spektraris NMR
Pseudolarolide O
Common Name: Pseudolarolide O
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H42O5/c1-17-14-30(15-18(2)26(32)35-30)33-23-16-29(6)22-9-8-21-19(7-10-24(31)34-27(21,3)4)13-20(22)11-12-28(29,5)25(17)23/h7,11,17-18,21-23,25H,8-10,12-16H2,1-6H3/t17-,18-,21-,22-,23-,25+,28-,29+,30?/m1/s1
InChIKey: InChIKey=GNGQIYWNWWWRFG-QAHHPZEFSA-N
Formula: C30H42O5
Molecular Weight: 482.652613
Exact Mass: 482.303224
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chen, G.F., Tan, C.H., Li, Z.L., Jiang, S.H., Zhu, D.Y. Helv Chim Acta (2003) 86, 787-92
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 (CH) | 119.5 |
| 2 (CH2) | 37.5 |
| 3 (C) | 171.8 |
| 4 (C) | 81.6 |
| 5 (CH) | 55.4 |
| 6 (CH2) | 30.9 |
| 7 (CH2) | 27.2 |
| 8 (CH) | 46 |
| 9 (C) | 139.8 |
| 10 (C) | 141.6 |
| 11 (CH) | 115.2 |
| 12 (CH2) | 36.2 |
| 13 (C) | 42.6 |
| 14 (C) | 47.6 |
| 15 (CH2) | 38.4 |
| 16 (CH) | 77.2 |
| 17 (CH) | 54.2 |
| 18 (CH3) | 16.6 |
| 19 (CH2) | 47.4 |
| 20 (CH) | 30.2 |
| 21 (CH3) | 19.3 |
| 22 (CH2) | 44.4 |
| 23 (C) | 107.3 |
| 24 (CH2) | 42.9 |
| 25 (CH) | 34.2 |
| 26 (C) | 179.6 |
| 27 (CH3) | 15 |
| 28 (CH3) | 26.2 |
| 29 (CH3) | 29.1 |
| 30 (CH3) | 20.7 |
