Spektraris NMR
Yunganogenin D
Common Name: Yunganogenin D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H48O3/c1-25(2)16-20-19-8-9-22-27(4)12-11-23(32)28(5,18-31)21(27)10-13-30(22,7)29(19,6)15-14-26(20,3)24(33)17-25/h8-9,21-24,31-33H,10-18H2,1-7H3/t21-,22-,23+,24-,26-,27+,28-,29-,30-/m1/s1
InChIKey: InChIKey=UYFNGLXEVHHHOS-ZMNQYPNASA-N
Formula: C30H48O3
Molecular Weight: 456.701448
Exact Mass: 456.360345
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Akai, E., Takeda, T., Kobayashi, Y., Chen, Y., Ogibara, Y. Chem Pharm Bull (1985) 33, 4681
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Oleananes; 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) | 38.9 |
| 2 (CH2) | 29 |
| 3 (CH) | 80.1 |
| 4 (C) | 39.8 |
| 5 (CH) | 56.4 |
| 6 (CH2) | 19.6 |
| 7 (CH2) | 34 |
| 8 (C) | 40.7 |
| 9 (CH) | 54.8 |
| 10 (C) | 39.8 |
| 11 (CH) | 127.3 |
| 12 (CH) | 126.3 |
| 13 (C) | 138.3 |
| 14 (C) | 40.8 |
| 15 (CH2) | 25 |
| 16 (CH2) | 35.6 |
| 17 (C) | 42 |
| 18 (C) | 135 |
| 19 (CH2) | 38.4 |
| 20 (C) | 43.2 |
| 21 (CH2) | 43.3 |
| 22 (CH) | 75.6 |
| 23 (CH3) | 23.3 |
| 24 (CH2) | 64.5 |
| 25 (CH3) | 18.3 |
| 26 (CH3) | 16.9 |
| 27 (CH3) | 25.4 |
| 28 (CH3) | 23.6 |
| 29 (CH3) | 25 |
| 30 (CH3) | 29.1 |
