Spektraris NMR
Caesalpinin L
Common Name: Caesalpinin L
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H34O7/c1-13(25)30-18-12-24(28)21(3,4)9-7-19(31-14(2)26)22(24,5)16-11-17-15(8-10-29-17)23(6,27)20(16)18/h8,10,16,18-20,27-28H,7,9,11-12H2,1-6H3/t16-,18-,19-,20-,22-,23-,24+/m0/s1
InChIKey: InChIKey=ZUOSXOQNJTXIGG-XWVCWXBLSA-N
Formula: C24H34O7
Molecular Weight: 434.523482
Exact Mass: 434.230453
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Awale, S., Linn, T.Z., Tezuka, Y., Kalauni, S.K., Banskota, A.H., Attamimi, F., Ueda, J.Y., Kadota, S. Chem Pharm Bull (2006) 54, 213-8
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Vouacapanes; 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) | 75.5 |
| 2 (CH2) | 22.4 |
| 3 (CH2) | 29.8 |
| 4 (C) | 38.4 |
| 5 (C) | 78 |
| 6 (CH2) | 31.7 |
| 7 (CH) | 72.9 |
| 8 (CH) | 47 |
| 9 (CH) | 36.2 |
| 10 (C) | 43.5 |
| 11 (CH2) | 21.4 |
| 12 (C) | 147.6 |
| 13 (C) | 124.2 |
| 14 (C) | 72.3 |
| 15 (CH) | 107.5 |
| 16 (CH) | 141.7 |
| 17 (CH3) | 26.2 |
| 18 (CH3) | 28 |
| 19 (CH3) | 25.2 |
| 20 (CH3) | 17.8 |
| 1a (C) | 169.7 |
| 1b (CH3) | 21.7 |
| 7a (C) | 168.9 |
| 7b (CH3) | 22 |
