| SpectraBase Compound ID | Idd3YMkQ5qV |
|---|---|
| InChI | InChI=1S/C46H77NO19/c1-8-16-31(50)17-14-12-10-9-11-13-15-18-35(52)64-43-42(66-45-40(57)39(56)36(53)27(4)61-45)41(65-44(58)25(2)26(3)48)28(5)62-46(43)63-34(23-47-30-19-21-32(59-7)22-20-30)38(55)37(54)33(51)24-60-29(6)49/h19-22,25-28,31,33-34,36-43,45-48,50-51,53-57H,8-18,23-24H2,1-7H3/t25-,26-,27-,28+,31+,33+,34-,36-,37-,38+,39+,40+,41+,42-,43-,45-,46+/m1/s1 |
| InChIKey | XENRGXAMQUMJSY-WRKMQHDBSA-N |
| Mol Weight | 948.1 g/mol |
| Molecular Formula | C46H77NO19 |
| Exact Mass | 947.508979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1HUPyDem7Qs |
|---|---|
| Name | XENRGXAMQUMJSY-WRKMQHDBSA-N |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H77NO19 |
| InChI | InChI=1S/C46H77NO19/c1-8-16-31(50)17-14-12-10-9-11-13-15-18-35(52)64-43-42(66-45-40(57)39(56)36(53)27(4)61-45)41(65-44(58)25(2)26(3)48)28(5)62-46(43)63-34(23-47-30-19-21-32(59-7)22-20-30)38(55)37(54)33(51)24-60-29(6)49/h19-22,25-28,31,33-34,36-43,45-48,50-51,53-57H,8-18,23-24H2,1-7H3/t25-,26-,27-,28+,31+,33+,34-,36-,37-,38+,39+,40+,41+,42-,43-,45-,46+/m1/s1 |
| InChIKey | XENRGXAMQUMJSY-WRKMQHDBSA-N |
| Literature Reference Author | K.MIYAHARA,X.M.DU,M.WATANABE,C.SUGIMURA,S.YAHARA,T.NOHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,481(1996) |
| Literature Reference DOI | 10.1248/cpb.44.481 |
| Molecular Weight | 948.113 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU31424 |