Spektraris NMR
3α,4α-Epoxy-18-hydroxysphenoloba-13E(15),16E-diene
Common Name: 3α,4α-Epoxy-18-hydroxysphenoloba-13E(15),16E-diene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-14(7-6-10-18(2,3)21)15-8-11-19(4)13-17-20(5,22-17)12-9-16(15)19/h6-7,10,15-17,21H,8-9,11-13H2,1-5H3/b10-6+,14-7+/t15-,16-,17-,19+,20+/m0/s1
InChIKey: InChIKey=UDVZMOTUBCVGTA-RBFKKOESSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Shao, Y., Bai, N.S., Zhou, B.N. Phytochemistry (1996) 42, 783-6
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Sphenolobanes; 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) | 23.1 |
| 2 (CH2) | 36.1 |
| 3 (C) | 60.1 |
| 4 (CH) | 61 |
| 5 (CH2) | 41.4 |
| 6 (C) | 43.9 |
| 7 (CH2) | 39.9 |
| 8 (CH2) | 26.2 |
| 9 (CH) | 52.7 |
| 10 (CH) | 57.5 |
| 11 (CH3) | 23.4 |
| 12 (CH3) | 17.5 |
| 13 (C) | 140.1 |
| 14 (CH3) | 13.2 |
| 15 (CH) | 125.2 |
| 16 (CH) | 122.9 |
| 17 (CH) | 139.2 |
| 18 (C) | 70.8 |
| 19 (CH3) | 29.9 |
| 20 (CH3) | 29.9 |
