Common Name: Foveoglin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C38H40N2O8/c1-45-27-18-16-26(17-19-27)38-33(35(42)40-21-11-10-20-39-34(41)25-14-8-5-9-15-25)31(24-12-6-4-7-13-24)37(44,36(38)43)32-29(47-3)22-28(46-2)23-30(32)48-38/h4-9,12-19,22-23,31,33,36,43-44H,10-11,20-21H2,1-3H3,(H,39,41)(H,40,42)/t31-,33+,36-,37+,38+/m1/s1
InChIKey: InChIKey=OUOMPABBALUSRC-SYACSPTMSA-N
Formula: C38H40N2O8
Molecular Weight: 652.73432
Exact Mass: 652.278466
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Salim, A.A., Chai, H.B., Rachman, I., Riswan, S., Kardono, L.B.S., Farnsworth, N.R., Carcache-Blanco, E.J., Kinghorn, A.D. Tetrahedron (2007) 63, 7926-34
Species:
Notes: Family : Flavonoids, Type : Flavaglines; 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) | 85.6 |
3 (CH) | 59 |
4 (CH) | 57.1 |
5 (C) | 81.8 |
6 (C) | 160.3 |
7 (CH) | 93 |
8 (C) | 160.8 |
9 (CH) | 93.9 |
10 (C) | 152.8 |
11 (C) | 104.2 |
12 (CH) | 73.5 |
1' (C) | 129.2 |
2' (CH) | 128 |
3' (CH) | 113.6 |
4' (C) | 159.3 |
5' (CH) | 113.6 |
6' (CH) | 128 |
1'' (C) | 136.8 |
2'' (CH) | 128.6 |
3'' (CH) | 127.7 |
4'' (CH) | 127 |
5'' (CH) | 127.7 |
6'' (CH) | 128.6 |
3a (C) | 170 |
3b (CH2) | 39 |
3c (CH2) | 26.2 |
3d (CH2) | 26.3 |
3e (CH2) | 39.4 |
3f (C) | 167.5 |
3g (C) | 134.5 |
3h (CH) | 127 |
3i (CH) | 128.6 |
3j (CH) | 131.5 |
3k (CH) | 128.6 |
3l (CH) | 127 |
6a (CH3) | 55.5 |
8a (CH3) | 55.4 |
4'a (CH3) | 55.4 |