| SpectraBase Compound ID | CSuOjJ9kXOE |
|---|---|
| InChI | InChI=1S/C61H94O24/c1-14-27(3)50(73)81-44-29(5)78-54(43(71)45(44)82-51(74)28(4)15-2)85-49-48(72)61(26-77-30(6)64)32(22-56(49,7)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)65)80-55-47(41(69)40(68)46(83-55)52(75)76-13)84-53-42(70)39(67)38(66)33(24-62)79-53/h14-16,29,32-49,53-55,62-63,65-72H,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 | KSIAJCATMJQLOZ-XNRCHHNQSA-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 | BdQizFRwLK7 |
|---|---|
| Name | M-B2 |
| 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)78-54(43(71)45(44)82-51(74)28(4)15-2)85-49-48(72)61(26-77-30(6)64)32(22-56(49,7)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)65)80-55-47(41(69)40(68)46(83-55)52(75)76-13)84-53-42(70)39(67)38(66)33(24-62)79-53/h14-16,29,32-49,53-55,62-63,65-72H,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 | KSIAJCATMJQLOZ-XNRCHHNQSA-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 |