| SpectraBase Compound ID | KxoMC3qoeD8 |
|---|---|
| InChI | InChI=1S/C51H75N15O11/c1-51(21-12-26-66(51)46(74)39-20-11-25-65(39)44(72)33(52)17-8-22-57-49(53)54)48(77)59-29-40(68)60-35(27-31-13-4-2-5-14-31)41(69)63-37(30-67)45(73)64-24-10-19-38(64)43(71)62-36(28-32-15-6-3-7-16-32)42(70)61-34(47(75)76)18-9-23-58-50(55)56/h2-7,13-16,33-39,67H,8-12,17-30,52H2,1H3,(H,59,77)(H,60,68)(H,61,70)(H,62,71)(H,63,69)(H,75,76)(H4,53,54,57)(H4,55,56,58) |
| InChIKey | ROOPHZGBZGYIRY-UHFFFAOYSA-N |
| Mol Weight | 1074.3 g/mol |
| Molecular Formula | C51H75N15O11 |
| Exact Mass | 1073.577048 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | wkEJFFL70q |
|---|---|
| Name | 3-alpha-METHYLPROLINE-BRADYKININ |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C51H75N15O11/c1-51(21-12-26-66(51)46(74)39-20-11-25-65(39)44(72)33(52)17-8-22-57-49(53)54)48(77)59-29-40(68)60-35(27-31-13-4-2-5-14-31)41(69)63-37(30-67)45(73)64-24-10-19-38(64)43(71)62-36(28-32-15-6-3-7-16-32)42(70)61-34(47(75)76)18-9-23-58-50(55)56/h2-7,13-16,33-39,67H,8-12,17-30,52H2,1H3,(H,59,77)(H,60,68)(H,61,70)(H,62,71)(H,63,69)(H,75,76)(H4,53,54,57)(H4,55,56,58) |
| InChIKey | ROOPHZGBZGYIRY-UHFFFAOYSA-N |
| Literature Reference | O.ZERBE,J.H.WELSH,J.A.ROBINSON,W.VONPHILIPSBORN MAGN.RES.CHEM.,30,683(1992) |
| Solvent | Deuterium oxide |