Spektraris NMR
Desacetylfevicordin A
Common Name: Desacetylfevicordin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C29H40O7/c1-15-16-8-9-20-26(4)13-19(31)24(29(7,36)21(32)10-11-25(2,3)35)27(26,5)14-22(33)28(20,6)17(16)12-18(30)23(15)34/h10-12,19-20,24,30-31,34-36H,8-9,13-14H2,1-7H3/b11-10+/t19-,20+,24+,26+,27-,28+,29+/m1/s1
InChIKey: InChIKey=XDSLUVLOHDTQGH-SUBQQBBLSA-N
Formula: C29H40O7
Molecular Weight: 500.624806
Exact Mass: 500.277404
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Kurnia, D., Akiyama, K., Hayashi, H. Biosci Biotechnol Biochem (2008) 72, 618-20
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Cucurbitanes; 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) | 110.3 |
| 2 (C) | 142.9 |
| 3 (C) | 143.9 |
| 4 (C) | 124.4 |
| 5 (C) | 129.9 |
| 6 (CH2) | 25.3 |
| 7 (CH2) | 20.6 |
| 8 (CH) | 44.2 |
| 9 (C) | 52.1 |
| 10 (C) | 126.9 |
| 11 (C) | 217.2 |
| 12 (CH2) | 51.9 |
| 13 (C) | 51.5 |
| 14 (C) | 49.8 |
| 15 (CH2) | 46.4 |
| 16 (CH) | 71.5 |
| 17 (CH) | 59.7 |
| 18 (CH3) | 20.4 |
| 19 (CH3) | 29.2 |
| 20 (C) | 79.9 |
| 21 (CH3) | 24.7 |
| 22 (C) | 205.1 |
| 23 (CH) | 121.2 |
| 24 (CH) | 155.3 |
| 25 (C) | 71.5 |
| 26 (CH3) | 29.3 |
| 27 (CH3) | 29.3 |
| 28 (CH3) | 11.5 |
| 30 (CH3) | 20 |
