| SpectraBase Compound ID | 3CcvpQzhLfO |
|---|---|
| InChI | InChI=1S/C48H49N5O12/c1-30-26-53(47(58)51-44(30)55)42-24-37(54)39(64-42)27-61-29-62-38-25-43(52-23-22-41(50-46(52)57)49-45(56)31-10-6-4-7-11-31)65-40(38)28-63-48(32-12-8-5-9-13-32,33-14-18-35(59-2)19-15-33)34-16-20-36(60-3)21-17-34/h4-23,26,37-40,42-43,54H,24-25,27-29H2,1-3H3,(H,51,55,58)(H,49,50,56,57)/t37-,38+,39+,40-,42+,43-/m0/s1 |
| InChIKey | OMOBQARHKJQFIZ-XFSLGKFESA-N |
| Mol Weight | 887.9 g/mol |
| Molecular Formula | C48H49N5O12 |
| Exact Mass | 887.337772 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AvRzOY58o7T |
|---|---|
| Name | OMOBQARHKJQFIZ-XFSLGKFESA-N |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H49N5O12 |
| InChI | InChI=1S/C48H49N5O12/c1-30-26-53(47(58)51-44(30)55)42-24-37(54)39(64-42)27-61-29-62-38-25-43(52-23-22-41(50-46(52)57)49-45(56)31-10-6-4-7-11-31)65-40(38)28-63-48(32-12-8-5-9-13-32,33-14-18-35(59-2)19-15-33)34-16-20-36(60-3)21-17-34/h4-23,26,37-40,42-43,54H,24-25,27-29H2,1-3H3,(H,51,55,58)(H,49,50,56,57)/t37-,38+,39+,40-,42+,43-/m0/s1 |
| InChIKey | OMOBQARHKJQFIZ-XFSLGKFESA-N |
| Literature Reference Author | P.J.M.L.QUAEDFLIEG,G.A.VANDERMAREL,E.KUYL-YEHESKIELY,J.H.VAN BOOM |
| Literature Reference Citation | REC.TR.CH.P.-B.,110,435(1991) |
| Literature Reference DOI | 10.1002/recl.19911101008 |
| Molecular Weight | 887.943 g/mol |
| Solvent | Unknown |
| Source File Reference | UWTS2377 |