| SpectraBase Compound ID | ILU0cFfiwM6 |
|---|---|
| InChI | InChI=1S/C41H64O13/c1-19-10-15-40(35(47)48)16-17-41(36(49)50)22(27(40)20(19)2)8-9-25-38(6)13-12-26(37(4,5)24(38)11-14-39(25,41)7)53-34-31(46)32(28(43)21(3)52-34)54-33-30(45)29(44)23(42)18-51-33/h8,19-21,23-34,42-46H,9-18H2,1-7H3,(H,47,48)(H,49,50)/t19-,20+,21-,23-,24?,25?,26+,27?,28-,29+,30-,31-,32+,33+,34+,38+,39-,40+,41-/m0/s1 |
| InChIKey | BVSGHFUJMZEKGT-VBWPCKNWSA-N |
| Mol Weight | 765.0 g/mol |
| Molecular Formula | C41H64O13 |
| Exact Mass | 764.434692 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hu9US0MowS1 |
|---|---|
| Name | QUINOVIC ACID-3B-O-(B-D-XYLOPYRANOSYL(3->1)B-D-QUINOVOPYRANOSIDE) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C41H64O13 |
| InChI | InChI=1S/C41H64O13/c1-19-10-15-40(35(47)48)16-17-41(36(49)50)22(27(40)20(19)2)8-9-25-38(6)13-12-26(37(4,5)24(38)11-14-39(25,41)7)53-34-31(46)32(28(43)21(3)52-34)54-33-30(45)29(44)23(42)18-51-33/h8,19-21,23-34,42-46H,9-18H2,1-7H3,(H,47,48)(H,49,50)/t19-,20+,21-,23-,24?,25?,26+,27?,28-,29+,30-,31-,32+,33+,34+,38+,39-,40+,41-/m0/s1 |
| InChIKey | BVSGHFUJMZEKGT-VBWPCKNWSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |