Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H20O10/c18-3-4-24-16-12(7-19)27-17(15(23)14(16)22)26-11-6-10-8(5-9(11)20)1-2-13(21)25-10/h1-2,5-6,12,14-20,22-23H,3-4,7H2/t12-,14-,15-,16-,17-/m1/s1
InChIKey: InChIKey=JIOWROBWYILDBB-LMHBHQSJSA-N
Formula: C17H20O10
Molecular Weight: 384.335375
Exact Mass: 384.105647
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Cuca Suarez, L.E., R., M.C.D., Orozco, C.I. Revista Colombiana de Quimica (2006) 35, 59-65
Species:
Notes: Family : Chromans, Type : Coumarins, Group : Coumarins; 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)
Position | PPM |
---|---|
2 (C) | 163.4 |
3 (CH) | 114.4 |
4 (CH) | 145.8 |
5 (CH) | 104.2 |
6 (C) | 148.8 |
7 (C) | 149.6 |
8 (CH) | 114 |
9 (C) | 144.4 |
10 (C) | 114.4 |
1' (CH) | 101.4 |
2' (CH) | 73.9 |
3' (CH) | 77.6 |
4' (CH) | 70.6 |
5' (CH) | 76.5 |
6' (CH2) | 61.6 |
4'a (CH2) | 61.3 |
4'b (CH2) | 72.7 |