| SpectraBase Compound ID | CNIBenkMd68 |
|---|---|
| InChI | InChI=1S/C44H70O14/c1-22-31(49)36(58-37-34(52)33(51)32(50)26(56-37)19-54-23(2)47)35(53)38(55-22)57-30-12-13-40(5)27(41(30,6)20-45)11-14-42(7)28(40)10-9-24-25-17-39(3,4)15-16-44(25,21-46)29(48)18-43(24,42)8/h9-10,22,26-38,45-46,48-53H,11-21H2,1-8H3/t22?,26?,27?,28?,29-,30?,31?,32?,33?,34?,35?,36?,37?,38?,40?,41?,42?,43-,44+/m1/s1 |
| InChIKey | JVVGHTDCSIJQTI-JNNVLHQISA-N |
| Mol Weight | 823.0 g/mol |
| Molecular Formula | C44H70O14 |
| Exact Mass | 822.476557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5j4MdO3zYXg |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C44H70O14 |
| InChI | InChI=1S/C44H70O14/c1-22-31(49)36(58-37-34(52)33(51)32(50)26(56-37)19-54-23(2)47)35(53)38(55-22)57-30-12-13-40(5)27(41(30,6)20-45)11-14-42(7)28(40)10-9-24-25-17-39(3,4)15-16-44(25,21-46)29(48)18-43(24,42)8/h9-10,22,26-38,45-46,48-53H,11-21H2,1-8H3/t22?,26?,27?,28?,29-,30?,31?,32?,33?,34?,35?,36?,37?,38?,40?,41?,42?,43-,44+/m1/s1 |
| InChIKey | JVVGHTDCSIJQTI-JNNVLHQISA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | Chem. Pharm. Bull. 34, 1158 (1986). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |