![3',4'-di-O-methylquercetin-7-O-[(4''->13''')-2''',6''',10''',14'''-tetramethylhexadec-13'''-ol-14'''-enyl]-.beta.-D-glucopyranoside](/api/spectrum/DiwxtMz8QBW/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")
| SpectraBase Compound ID | 2qFbSKUoN3D |
|---|---|
| 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 |
| Mol Weight | 771.0 g/mol |
| Molecular Formula | C43H62O12 |
| Exact Mass | 770.424127 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DiwxtMz8QBW |
|---|---|
| Name | 3',4'-di-O-Methylquercitin-7-O-[(4",13''')-2"'.6"',10"',14"'-tetramethylhexadec-13"'-ol-14"'-enyl]-.beta.-glucopyranoside |
| 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 |
| Molecular Weight | 770.957 g/mol |
| SMILES | O[C@]1([C@@]([C@](O[C@]([C@@]1(O)[H])(Oc1cc2OC(=C(C(c2c(c1)O)=O)O)c1cc(OC)c(cc1)OC)[H])(CO)[H])(OC(\C(=C\C)C)CCC(CCCC(CCCC(C)C)C)C)[H])[H] |
| SPLASH | splash10-052r-9810000000-c10544e88d7dd22c428e |
| Source of Spectrum | G4-72-618-1 |
| Wiley ID | 1702069 |