| SpectraBase Compound ID | 5GWbwvZkIAi |
|---|---|
| InChI | InChI=1S/C57H92O27/c1-22-33(65)42(80-46-39(71)34(66)26(61)18-75-46)41(73)48(78-22)82-43-36(68)28(63)20-77-49(43)84-51(74)57-13-12-52(2,3)14-24(57)23-8-9-31-53(4)15-25(60)45(54(5,21-59)30(53)10-11-55(31,6)56(23,7)16-32(57)64)83-50-44(38(70)37(69)29(17-58)79-50)81-47-40(72)35(67)27(62)19-76-47/h8,22,24-50,58-73H,9-21H2,1-7H3/t22?,24?,25-,26?,27?,28?,29?,30?,31?,32+,33?,34?,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45-,46?,47?,48?,49?,50?,53-,54-,55+,56+,57+/m0/s1 |
| InChIKey | DAHCHOITPUBHEH-ZABCLBCKSA-N |
| Mol Weight | 1209.3 g/mol |
| Molecular Formula | C57H92O27 |
| Exact Mass | 1208.582598 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JIWec3Q731L |
|---|---|
| Name | DAHCHOITPUBHEH-ZABCLBCKSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H92O27 |
| InChI | InChI=1S/C57H92O27/c1-22-33(65)42(80-46-39(71)34(66)26(61)18-75-46)41(73)48(78-22)82-43-36(68)28(63)20-77-49(43)84-51(74)57-13-12-52(2,3)14-24(57)23-8-9-31-53(4)15-25(60)45(54(5,21-59)30(53)10-11-55(31,6)56(23,7)16-32(57)64)83-50-44(38(70)37(69)29(17-58)79-50)81-47-40(72)35(67)27(62)19-76-47/h8,22,24-50,58-73H,9-21H2,1-7H3/t22?,24?,25-,26?,27?,28?,29?,30?,31?,32+,33?,34?,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45-,46?,47?,48?,49?,50?,53-,54-,55+,56+,57+/m0/s1 |
| InChIKey | DAHCHOITPUBHEH-ZABCLBCKSA-N |
| Literature Reference Author | R.KASAI,M.MIYAKOSHI,R.L.NIE,J.ZHOU,K.MATSUMOTO,T.MORITA,M.NI SHI,K.MIYAHARA,O.TAN |
| Literature Reference Citation | PHYTOCHEM.,27,1439(1988) |
| Literature Reference DOI | 10.1016/0031-9422(88)80212-7 |
| Molecular Weight | 1209.341 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK561 |