| SpectraBase Compound ID | DxlG0Tzuebr |
|---|---|
| InChI | InChI=1S/C61H94O24/c1-14-27(3)50(73)81-44-29(5)77-54(43(72)45(44)82-51(74)28(4)15-2)85-48-49(78-30(6)65)61(26-64)32(22-56(48,7)8)31-16-17-35-57(9)20-19-37(58(10,25-63)34(57)18-21-59(35,11)60(31,12)23-36(61)66)80-55-47(41(70)40(69)46(83-55)52(75)76-13)84-53-42(71)39(68)38(67)33(24-62)79-53/h14-16,29,32-49,53-55,62-64,66-72H,17-26H2,1-13H3/b27-14-,28-15+/t29?,32-,33-,34?,35?,36-,37?,38+,39+,40?,41?,42+,43?,44?,45?,46?,47?,48?,49-,53?,54?,55?,57?,58?,59?,60+,61-/m1/s1 |
| InChIKey | UWHLXQWIIKFBEF-WDKLYROUSA-N |
| Mol Weight | 1211.4 g/mol |
| Molecular Formula | C61H94O24 |
| Exact Mass | 1210.613504 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4G0WGCvcAWK |
|---|---|
| Name | M-B1 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C61H94O24 |
| InChI | InChI=1S/C61H94O24/c1-14-27(3)50(73)81-44-29(5)77-54(43(72)45(44)82-51(74)28(4)15-2)85-48-49(78-30(6)65)61(26-64)32(22-56(48,7)8)31-16-17-35-57(9)20-19-37(58(10,25-63)34(57)18-21-59(35,11)60(31,12)23-36(61)66)80-55-47(41(70)40(69)46(83-55)52(75)76-13)84-53-42(71)39(68)38(67)33(24-62)79-53/h14-16,29,32-49,53-55,62-64,66-72H,17-26H2,1-13H3/b27-14-,28-15+/t29?,32-,33-,34?,35?,36-,37?,38+,39+,40?,41?,42+,43?,44?,45?,46?,47?,48?,49-,53?,54?,55?,57?,58?,59?,60+,61-/m1/s1 |
| InChIKey | UWHLXQWIIKFBEF-WDKLYROUSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | Chem. Pharm. Bull. 33, 1387 (1985). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |