| SpectraBase Compound ID | F6ZyAUNIpkZ |
|---|---|
| InChI | InChI=1S/C41H57N5O12/c1-24(2)17-29(38(52)53)45-36(50)28(18-25-11-9-8-10-12-25)44-33(49)21-42-32(48)20-43-37(51)30(19-26-13-15-27(47)16-14-26)46(7)23-41-35(57-40(5,6)58-41)34-31(22-54-41)55-39(3,4)56-34/h8-16,24,28-31,34-35,47H,17-23H2,1-7H3,(H,42,48)(H,43,51)(H,44,49)(H,45,50)(H,52,53)/t28?,29?,30?,31-,34-,35+,41+/m1/s1 |
| InChIKey | HJZDXRSYUZIMKS-NPKJDYKTSA-N |
| Mol Weight | 811.9 g/mol |
| Molecular Formula | C41H57N5O12 |
| Exact Mass | 811.400372 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F5bp2CFnc6a |
|---|---|
| Name | N-(1-DEOXY-2,3:4,5-DI-O-ISOPROPYLIDENE-BETA-D-FRUCTOPYRANOS-1-YL)-N-METHYL-L-TYROSYLGLYCYLGLYCYL-L-PHENYLALANYL-L-LEUCINE;P-MEYGGFL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H57N5O12 |
| InChI | InChI=1S/C41H57N5O12/c1-24(2)17-29(38(52)53)45-36(50)28(18-25-11-9-8-10-12-25)44-33(49)21-42-32(48)20-43-37(51)30(19-26-13-15-27(47)16-14-26)46(7)23-41-35(57-40(5,6)58-41)34-31(22-54-41)55-39(3,4)56-34/h8-16,24,28-31,34-35,47H,17-23H2,1-7H3,(H,42,48)(H,43,51)(H,44,49)(H,45,50)(H,52,53)/t28?,29?,30?,31-,34-,35+,41+/m1/s1 |
| InChIKey | HJZDXRSYUZIMKS-NPKJDYKTSA-N |
| Literature Reference Author | S.HORVAT,A.JAKAS,E.VASS,J.SAMU,M.HOLLOSI |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-2,1523(1997) |
| Literature Reference DOI | 10.1039/a700499k |
| Molecular Weight | 811.930 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU6247 |