Spektraris NMR
(R)-Coluteol
Common Name: (R)-Coluteol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C18H20O6/c1-21-12-5-4-10-6-11(9-24-15(10)7-12)13-8-14(19)18(23-3)16(20)17(13)22-2/h4-5,7-8,11,19-20H,6,9H2,1-3H3/t11-/m0/s1
InChIKey: InChIKey=LXTMXFSTGUINPR-NSHDSACASA-N
Formula: C18H20O6
Molecular Weight: 332.348491
Exact Mass: 332.125988
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Grosvenor, P.W., Gray, D.O. J Nat Prod (1998) 61, 99-101
Species:
Notes: Family : Flavonoids, Type : Isoflavonoids, Group : Isoflavanes; 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 (CH2) | 70.2 |
| 3 (CH) | 31.4 |
| 4 (CH2) | 31.4 |
| 5 (CH) | 130.1 |
| 6 (CH) | 107.2 |
| 7 (C) | 159 |
| 8 (CH) | 101.3 |
| 9 (C) | 154.8 |
| 10 (C) | 114.1 |
| 1' (C) | 129.6 |
| 2' (C) | 139.2 |
| 3' (C) | 142 |
| 4' (C) | 133.6 |
| 5' (C) | 145.7 |
| 6' (CH) | 104 |
| 7a (CH3) | 55.2 |
| 2'a (CH3) | 61.9 |
| 4'a (CH3) | 60.8 |
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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.