Spektraris NMR
Acutifolin A
Common Name: Acutifolin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H22O4/c1-13(2)7-12-20-16(14-3-5-15(21)6-4-14)8-10-19(24,18(20)23)11-9-17(20)22/h3-7,9,11,16,21,24H,8,10,12H2,1-2H3/t16-,19-,20-/m0/s1
InChIKey: InChIKey=LDQGHYBYTNQNFR-VDGAXYAQSA-N
Formula: C20H22O4
Molecular Weight: 326.387034
Exact Mass: 326.151809
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Takashima, J., Ohsaki, A. J Nat Prod (2001) 64, 1493-6
Species:
Notes: Family : Miscellanea; 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 |
|---|---|
| 2 (CH) | 56 |
| 3 (CH2) | 27.9 |
| 4 (CH2) | 39 |
| 5 (CH) | 152.3 |
| 6 (CH) | 132.8 |
| 7 (C) | 199.2 |
| 8 (C) | 72.9 |
| 9 (C) | 209 |
| 10 (C) | 78.9 |
| 1' (C) | 130.2 |
| 2' (CH) | 131.3 |
| 3' (CH) | 115.6 |
| 4' (C) | 158 |
| 5' (CH) | 115.6 |
| 6' (CH) | 131.3 |
| 1'' (CH2) | 29.7 |
| 2'' (CH) | 121.1 |
| 3'' (C) | 134.2 |
| 4'' (CH3) | 26 |
| 5'' (CH3) | 18.1 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.