| SpectraBase Compound ID | 3r7yI1flJcA |
|---|---|
| InChI | InChI=1S/C35H57N3O25/c1-12(41)36-21-17(46)8-35(32(55)56,60-20(10-40)26(50)29-22(37-13(2)42)15(44)6-33(58-5,61-29)30(51)52)63-27(21)24(48)18(47)11-59-34(31(53)54)7-16(45)23(38-14(3)43)28(62-34)25(49)19(9-39)57-4/h15-29,39-40,44-50H,6-11H2,1-5H3,(H,36,41)(H,37,42)(H,38,43)(H,51,52)(H,53,54)(H,55,56)/t15-,16+,17+,18-,19-,20+,21-,22+,23-,24-,25-,26+,27-,28-,29+,33+,34-,35-/m1/s1 |
| InChIKey | MNHDHZWASNVNRZ-HPGCOYRTSA-N |
| Mol Weight | 919.8 g/mol |
| Molecular Formula | C35H57N3O25 |
| Exact Mass | 919.328114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1MHxzxkv05v |
|---|---|
| Name | K92P |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H57N3O25 |
| InChI | InChI=1S/C35H57N3O25/c1-12(41)36-21-17(46)8-35(32(55)56,60-20(10-40)26(50)29-22(37-13(2)42)15(44)6-33(58-5,61-29)30(51)52)63-27(21)24(48)18(47)11-59-34(31(53)54)7-16(45)23(38-14(3)43)28(62-34)25(49)19(9-39)57-4/h15-29,39-40,44-50H,6-11H2,1-5H3,(H,36,41)(H,37,42)(H,38,43)(H,51,52)(H,53,54)(H,55,56)/t15-,16+,17+,18-,19-,20+,21-,22+,23-,24-,25-,26+,27-,28-,29+,33+,34-,35-/m1/s1 |
| InChIKey | MNHDHZWASNVNRZ-HPGCOYRTSA-N |
| Literature Reference Author | R.A.PON,N.H.KHIEU,Q.L.YANG,J.R.BRISSON,H.J.JENNINGS |
| Literature Reference Citation | CAN.J.CHEM.,80,1055(2002) |
| Literature Reference DOI | 10.1139/v02-141 |
| Molecular Weight | 919.843 g/mol |
| Solvent | D2O |
| Source File Reference | UWVN27215 |