| SpectraBase Compound ID | HBT8Zscj5dW |
|---|---|
| InChI | InChI=1S/C48H80O18/c1-22-31(54)37(65-42-38(34(57)33(56)27(18-49)63-42)66-40-35(58)32(55)25(52)19-61-40)36(59)41(62-22)64-30-10-11-44(4)28(45(30,5)20-50)9-12-46(6)39(44)26(60-8)15-23-24-16-43(2,3)13-14-48(24,21-51)29(53)17-47(23,46)7/h15,22,24-42,49-59H,9-14,16-21H2,1-8H3/t22-,24?,25+,26-,27-,28?,29+,30+,31+,32-,33-,34+,35+,36-,37+,38-,39?,40-,41?,42+,44+,45+,46-,47-,48-/m1/s1 |
| InChIKey | UMOLOQQTALHBMF-GBBNVESHSA-N |
| Mol Weight | 945.1 g/mol |
| Molecular Formula | C48H80O18 |
| Exact Mass | 944.534466 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LXsSn7YTczY |
|---|---|
| Name | UMOLOQQTALHBMF-GBBNVESHSA-N |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H80O18 |
| InChI | InChI=1S/C48H80O18/c1-22-31(54)37(65-42-38(34(57)33(56)27(18-49)63-42)66-40-35(58)32(55)25(52)19-61-40)36(59)41(62-22)64-30-10-11-44(4)28(45(30,5)20-50)9-12-46(6)39(44)26(60-8)15-23-24-16-43(2,3)13-14-48(24,21-51)29(53)17-47(23,46)7/h15,22,24-42,49-59H,9-14,16-21H2,1-8H3/t22-,24?,25+,26-,27-,28?,29+,30+,31+,32-,33-,34+,35+,36-,37+,38-,39?,40-,41?,42+,44+,45+,46-,47-,48-/m1/s1 |
| InChIKey | UMOLOQQTALHBMF-GBBNVESHSA-N |
| Literature Reference Author | J.-K.DING,H.FUJINO,R.KASAI,N.FUJIMOTO,O.TANAKA,J.ZHOU,H.MATS UURA,T.FUWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,34,1158(1986) |
| Literature Reference DOI | 10.1248/cpb.34.1158 |
| Molecular Weight | 945.152 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK177 |