| SpectraBase Compound ID | H6bIaXVEITj |
|---|---|
| InChI | InChI=1S/C44H72N12O12/c1-21(2)33-39(63)47-19-31(59)53-35(23(5)6)41(65)49-26(10)44(68)56-16-12-14-28(56)38(62)46-18-30(58)52-34(22(3)4)40(64)48-20-32(60)54-36(24(7)8)42(66)50-25(9)43(67)55-15-11-13-27(55)37(61)45-17-29(57)51-33/h21-28,33-36H,11-20H2,1-10H3,(H,45,61)(H,46,62)(H,47,63)(H,48,64)(H,49,65)(H,50,66)(H,51,57)(H,52,58)(H,53,59)(H,54,60) |
| InChIKey | QAWKAMOEYMEUKS-UHFFFAOYSA-N |
| Mol Weight | 961.1 g/mol |
| Molecular Formula | C44H72N12O12 |
| Exact Mass | 960.539266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2QZv4FmuFvk |
|---|---|
| Name | Cyclo(alanyl-prolyl-glycyl-valyl-glycyl-valyl-alanyl-prolyl-glycyl-valyl-glycyl-valyl) |
| CAS Registry Number | 68254-62-6 |
| Comments | T1-VALUES ARE GIVEN WITH THREE DIGITS IN REFERENCE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C44H72N12O12 |
| InChI | InChI=1S/C44H72N12O12/c1-21(2)33-39(63)47-19-31(59)53-35(23(5)6)41(65)49-26(10)44(68)56-16-12-14-28(56)38(62)46-18-30(58)52-34(22(3)4)40(64)48-20-32(60)54-36(24(7)8)42(66)50-25(9)43(67)55-15-11-13-27(55)37(61)45-17-29(57)51-33/h21-28,33-36H,11-20H2,1-10H3,(H,45,61)(H,46,62)(H,47,63)(H,48,64)(H,49,65)(H,50,66)(H,51,57)(H,52,58)(H,53,59)(H,54,60) |
| InChIKey | QAWKAMOEYMEUKS-UHFFFAOYSA-N |
| Instrument Name | Jeol PS-100 |
| Literature Reference | M.A. Khaled, C. Venkatachalam, T. Trapane, J. Chem. Soc. Perkin II 1119 (1980). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |