| SpectraBase Compound ID | LyFnfgGM9cE |
|---|---|
| InChI | InChI=1S/C47H62O18/c1-22-29-14-15-34-44(10)19-32(59-24(3)49)41(47(13,57)35(54)16-17-43(8,9)56)45(44,11)20-36(55)46(34,12)30(29)18-31(37(22)60-25(4)50)64-42-40(63-28(7)53)39(62-27(6)52)38(61-26(5)51)33(65-42)21-58-23(2)48/h14-15,18,32-34,38-42,56-57H,16-17,19-21H2,1-13H3/t32-,33+,34+,38+,39-,40+,41+,42+,44?,45-,46+,47?/m1/s1 |
| InChIKey | AVLRFLNPWVYQPJ-HAPXGLFASA-N |
| Mol Weight | 915.0 g/mol |
| Molecular Formula | C47H62O18 |
| Exact Mass | 914.393615 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DR1CnE9R1t7 |
|---|---|
| Name | 29-NOR-1,2,3,4,5,10-HEXADEHYDRO-2-O-BETA-D-TETRA-O-ACETYLGLUCOPYRANOSYL-20R,25-DIHYDROXY-3,16-ALPHA-DIACETOXY-11,22-DIOXOCUCURBITAC-6-ENE |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H62O18 |
| InChI | InChI=1S/C47H62O18/c1-22-29-14-15-34-44(10)19-32(59-24(3)49)41(47(13,57)35(54)16-17-43(8,9)56)45(44,11)20-36(55)46(34,12)30(29)18-31(37(22)60-25(4)50)64-42-40(63-28(7)53)39(62-27(6)52)38(61-26(5)51)33(65-42)21-58-23(2)48/h14-15,18,32-34,38-42,56-57H,16-17,19-21H2,1-13H3/t32-,33+,34+,38+,39-,40+,41+,42+,44?,45-,46+,47?/m1/s1 |
| InChIKey | AVLRFLNPWVYQPJ-HAPXGLFASA-N |
| Literature Reference Author | M.E.O.MATOS,M.I.L.MACHADO,A.A.CRAVEIRO,F.J.A.MATOS,R.BRAZ-FI LHO |
| Literature Reference Citation | PHYTOCHEM.,30,1020(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)85301-F |
| Molecular Weight | 914.998 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU34141 |