| SpectraBase Compound ID | DRVnPOeQFkj |
|---|---|
| InChI | InChI=1S/C42H66O14/c1-19-10-15-41(37(52)56-35-33(49)31(47)29(45)23(18-43)54-35)16-17-42(36(50)51)22(27(41)20(19)2)8-9-25-39(6)13-12-26(38(4,5)24(39)11-14-40(25,42)7)55-34-32(48)30(46)28(44)21(3)53-34/h8,19-21,23-35,43-49H,9-18H2,1-7H3,(H,50,51)/t19-,20+,21-,23-,24?,25?,26+,27?,28-,29-,30+,31+,32-,33-,34+,35+,39+,40-,41+,42-/m0/s1 |
| InChIKey | AQLCKWUMMOZIEY-KWMLRMIOSA-N |
| Mol Weight | 795.0 g/mol |
| Molecular Formula | C42H66O14 |
| Exact Mass | 794.445257 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FucB6A9oCb1 |
|---|---|
| Name | 3B-O-beta-D-QUINOVOPYRANOSYL-QUINOVIC ACID(28->1)beta-D-GLUCOPYRANOSYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C42H66O14 |
| InChI | InChI=1S/C42H66O14/c1-19-10-15-41(37(52)56-35-33(49)31(47)29(45)23(18-43)54-35)16-17-42(36(50)51)22(27(41)20(19)2)8-9-25-39(6)13-12-26(38(4,5)24(39)11-14-40(25,42)7)55-34-32(48)30(46)28(44)21(3)53-34/h8,19-21,23-35,43-49H,9-18H2,1-7H3,(H,50,51)/t19-,20+,21-,23-,24?,25?,26+,27?,28-,29-,30+,31+,32-,33-,34+,35+,39+,40-,41+,42-/m0/s1 |
| InChIKey | AQLCKWUMMOZIEY-KWMLRMIOSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |