| SpectraBase Compound ID | GfCIBV047Yd |
|---|---|
| InChI | InChI=1S/C34H56N8O12/c1-14(2)23-30(50)37-20(11-12-22(45)46)28(48)40-26(19(8)44)33(53)41-25(18(7)43)32(52)35-16(5)27(47)36-17(6)34(54)42-13-9-10-21(42)29(49)38-24(15(3)4)31(51)39-23/h14-21,23-26,43-44H,9-13H2,1-8H3,(H,35,52)(H,36,47)(H,37,50)(H,38,49)(H,39,51)(H,40,48)(H,41,53)(H,45,46) |
| InChIKey | MMQMBOKMEJCRMN-UHFFFAOYSA-N |
| Mol Weight | 768.9 g/mol |
| Molecular Formula | C34H56N8O12 |
| Exact Mass | 768.401769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JKn5ncIYfE0 |
|---|---|
| Name | CYCLO-(-VAL-(1)-VAL-(2)-GLU-THR-(1)-THR-(2)-ALA-(1)-ALA-(2)-PRO-);MODEL_PEPTIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H56N8O12 |
| InChI | InChI=1S/C34H56N8O12/c1-14(2)23-30(50)37-20(11-12-22(45)46)28(48)40-26(19(8)44)33(53)41-25(18(7)43)32(52)35-16(5)27(47)36-17(6)34(54)42-13-9-10-21(42)29(49)38-24(15(3)4)31(51)39-23/h14-21,23-26,43-44H,9-13H2,1-8H3,(H,35,52)(H,36,47)(H,37,50)(H,38,49)(H,39,51)(H,40,48)(H,41,53)(H,45,46) |
| InChIKey | MMQMBOKMEJCRMN-UHFFFAOYSA-N |
| Literature Reference Author | J.UZAWA,M.URAI,T.BABA,H.SEKI,K.TANIGUCHI,K.USHIDA |
| Literature Reference Citation | J.NAT.PROD.,72,818(2009) |
| Literature Reference DOI | 10.1021/np800601j |
| Molecular Weight | 768.865 g/mol |
| Sample ID | 32516 |
| Solvent | H2O:D2O |