| SpectraBase Spectrum ID |
1djQQBhaWjc |
| Name |
3',4'-di-O-methylquercetin-7-O-[(4''->13''')-2''',6''',10''',14'''-tetramethylhexadec-13'''-ol-14'''-enyl]-.beta.-D-glucopyranoside |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H62O12 |
| InChI |
InChI=1S/C43H62O12/c1-9-27(6)31(18-16-26(5)15-11-14-25(4)13-10-12-24(2)3)53-42-35(23-44)55-43(40(49)39(42)48)52-29-21-30(45)36-34(22-29)54-41(38(47)37(36)46)28-17-19-32(50-7)33(20-28)51-8/h9,17,19-22,24-26,31,35,39-40,42-45,47-49H,10-16,18,23H2,1-8H3/b27-9+/t25?,26?,31?,35-,39-,40-,42-,43-/m1/s1 |
| InChIKey |
NJNVTGXVNWOETM-YDYICKJWSA-N |
| Instrument Name |
JEOL JMS-SX 102A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np800378q |
| Molecular Weight |
770.957 g/mol |
| Optical Rotation |
[a]D22 = -52.1 (c = 0.6, MeOH) |
| Reported Formula |
C43H62O12 |
| SMILES |
OC[C@@]1([C@]([C@@]([C@]([C@@](O1)(Oc1cc(c2C(=O)C(O)=C(c3ccc(OC)c(OC)c3)Oc2c1)O)[H])(O)[H])(O)[H])(OC(\C(=C\C)C)CCC(C)CCCC(C)CCCC(C)C)[H])[H] |
| SPLASH |
splash10-0a5a-9510000000-5e39e6d23e77ff073592 |
| Source of Spectrum |
G4-72-618-1 |
| Thin-Layer Chromatography |
Rf = 0.71 (CHCl3/MeOH, 9:1) |
| Wiley ID |
1872165 |
![3',4'-di-O-methylquercetin-7-O-[(4''->13''')-2''',6''',10''',14'''-tetramethylhexadec-13'''-ol-14'''-enyl]-.beta.-D-glucopyranoside](/api/spectrum/1djQQBhaWjc/structure.png?h=300&w=458 "3',4'-di-O-methylquercetin-7-O-[(4''->13''')-2''',6''',10''',14'''-tetramethylhexadec-13'''-ol-14'''-enyl]-.beta.-D-glucopyranoside")
