![GYPSOPHIN-E;CYCLO-[PROLINE(1)-GLYCINE(2)-LEUCINE(3)-VALINE(4)-PROLINE(5)-ISOLEUCINE(6)-GLYCINE(7)]](/api/spectrum/KhNyeK1ioNe/structure.png?h=300&w=458 "GYPSOPHIN-E;CYCLO-[PROLINE(1)-GLYCINE(2)-LEUCINE(3)-VALINE(4)-PROLINE(5)-ISOLEUCINE(6)-GLYCINE(7)]")
| SpectraBase Compound ID | 2V4hsvsT18b |
|---|---|
| InChI | InChI=1S/C31H51N7O7/c1-7-19(6)26-30(44)33-16-24(40)37-12-8-10-21(37)28(42)32-15-23(39)34-20(14-17(2)3)27(41)35-25(18(4)5)31(45)38-13-9-11-22(38)29(43)36-26/h17-22,25-26H,7-16H2,1-6H3,(H,32,42)(H,33,44)(H,34,39)(H,35,41)(H,36,43)/t19?,20-,21-,22-,25-,26-/m0/s1 |
| InChIKey | LXBMCXWDRVCTSF-UVEHCDLNSA-N |
| Mol Weight | 633.8 g/mol |
| Molecular Formula | C31H51N7O7 |
| Exact Mass | 633.384997 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KhNyeK1ioNe |
|---|---|
| Name | GYPSOPHIN-E;CYCLO-[PROLINE(1)-GLYCINE(2)-LEUCINE(3)-VALINE(4)-PROLINE(5)-ISOLEUCINE(6)-GLYCINE(7)] |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H51N7O7 |
| InChI | InChI=1S/C31H51N7O7/c1-7-19(6)26-30(44)33-16-24(40)37-12-8-10-21(37)28(42)32-15-23(39)34-20(14-17(2)3)27(41)35-25(18(4)5)31(45)38-13-9-11-22(38)29(43)36-26/h17-22,25-26H,7-16H2,1-6H3,(H,32,42)(H,33,44)(H,34,39)(H,35,41)(H,36,43)/t19?,20-,21-,22-,25-,26-/m0/s1 |
| InChIKey | LXBMCXWDRVCTSF-UVEHCDLNSA-N |
| Literature Reference Author | G.WANG,J.G.LUO,M.H.YANG,X.B.WANG,L.Y.KONG |
| Literature Reference Citation | CHEM.PHARM.BULL.,61,489(2013) |
| Literature Reference DOI | 10.1248/cpb.c12-01094 |
| Molecular Weight | 633.789 g/mol |
| Source File Reference | UWBT4928 |