| SpectraBase Compound ID | 5GenOsJx0Zc |
|---|---|
| InChI | InChI=1S/C59H66O34/c1-22-46(80-28(7)65)51(83-31(10)68)54(86-34(13)71)57(76-22)93-56-53(85-33(12)70)49(82-30(9)67)43(21-75-24(3)61)91-59(56)92-50-45(73)44-40(79-27(6)64)18-37(19-41(44)89-47(50)36-15-16-38(77-25(4)62)39(17-36)78-26(5)63)88-58-55(87-35(14)72)52(84-32(11)69)48(81-29(8)66)42(90-58)20-74-23(2)60/h15-19,22,42-43,46,48-49,51-59H,20-21H2,1-14H3/t22-,42-,43+,46-,48-,49-,51+,52+,53-,54+,55-,56+,57-,58-,59-/m1/s1 |
| InChIKey | DHTOTZDLIIKLSP-MANOFDQFSA-N |
| Mol Weight | 1319.1 g/mol |
| Molecular Formula | C59H66O34 |
| Exact Mass | 1318.343549 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DmaafsGgcmM |
|---|---|
| Name | QUERCETIN-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSIDE-7-O-BETA-D-GLUCOPYRANOSIDE-PERACETYLATED |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H66O34 |
| InChI | InChI=1S/C59H66O34/c1-22-46(80-28(7)65)51(83-31(10)68)54(86-34(13)71)57(76-22)93-56-53(85-33(12)70)49(82-30(9)67)43(21-75-24(3)61)91-59(56)92-50-45(73)44-40(79-27(6)64)18-37(19-41(44)89-47(50)36-15-16-38(77-25(4)62)39(17-36)78-26(5)63)88-58-55(87-35(14)72)52(84-32(11)69)48(81-29(8)66)42(90-58)20-74-23(2)60/h15-19,22,42-43,46,48-49,51-59H,20-21H2,1-14H3/t22-,42-,43+,46-,48-,49-,51+,52+,53-,54+,55-,56+,57-,58-,59-/m1/s1 |
| InChIKey | DHTOTZDLIIKLSP-MANOFDQFSA-N |
| Literature Reference Author | M.KAOUADJI,A.DOUCOURE,A.M.MARIOTTE,A.J.CHULIA,F.THOMASSON |
| Literature Reference Citation | PHYTOCHEM.,29,1283(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85443-J |
| Molecular Weight | 1319.153 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWVN29598 |