Spektraris NMR
Artocommunol CC
Common Name: Artocommunol CC
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H32O7/c1-16(2)7-6-11-30(5)12-10-19-23(37-30)15-21(32)25-26(33)20-14-24(29(3,4)34)35-22-13-17(31)8-9-18(22)27(20)36-28(19)25/h7-10,12-13,15,24,31-32,34H,6,11,14H2,1-5H3/t24-,30?/m0/s1
InChIKey: InChIKey=DNQGMSASTSNOOR-YJJLJQPASA-N
Formula: C30H32O7
Molecular Weight: 504.572016
Exact Mass: 504.214803
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Chan, S.C., Ko, H.H., Lin, C.N. J Nat Prod (2003) 66, 427-30
Species:
Notes: Family : Flavonoids, Type : Flavonoids, Group : Flavones; 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 (C) | 158.5 |
| 3 (C) | 117.4 |
| 4 (C) | 181.9 |
| 5 (C) | 162.5 |
| 6 (CH) | 99.7 |
| 7 (C) | 160.5 |
| 8 (C) | 101.5 |
| 9 (C) | 152.5 |
| 10 (C) | 104.3 |
| 1' (C) | 114.7 |
| 2' (C) | 161.4 |
| 3' (CH) | 108.5 |
| 4' (C) | 162.2 |
| 5' (CH) | 112.2 |
| 6' (CH) | 131 |
| 1'' (CH) | 116 |
| 2'' (CH) | 127.2 |
| 3'' (C) | 81.3 |
| 4'' (CH2) | 42 |
| 5'' (CH2) | 23.2 |
| 6'' (CH) | 124.7 |
| 7'' (C) | 132.1 |
| 8'' (CH3) | 25.7 |
| 9'' (CH3) | 17.6 |
| 10'' (CH3) | 27 |
| 3a (CH2) | 25.6 |
| 3b (CH) | 86.3 |
| 3c (C) | 83.3 |
| 3d (CH3) | 22.4 |
| 3e (CH3) | 20.1 |
