| SpectraBase Compound ID | 1epoh3c0baM |
|---|---|
| InChI | InChI=1S/C33H45N3O15/c1-17(37)46-16-24-26(47-18(2)38)27(48-19(3)39)28(49-20(4)40)30(50-24)36-25(41)15-23(31(43)45-8)34-29(42)22(14-21-12-10-9-11-13-21)35-32(44)51-33(5,6)7/h9-13,22-24,26-28,30H,14-16H2,1-8H3,(H,34,42)(H,35,44)(H,36,41)/t22-,23-,24-,26+,27+,28-,30+/m0/s1 |
| InChIKey | XYGJXOAVUXCMOP-UNOKFMIESA-N |
| Mol Weight | 723.7 g/mol |
| Molecular Formula | C33H45N3O15 |
| Exact Mass | 723.285068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CaTjrqFqLbD |
|---|---|
| Name | N-TERT.-BUTOXYCARBONYL-L-PHENYLALANYL-N(GAMMA)-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-GALACTOPYRANOSYL)-L-ASPARAGINE-METHYLESTER |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H45N3O15 |
| InChI | InChI=1S/C33H45N3O15/c1-17(37)46-16-24-26(47-18(2)38)27(48-19(3)39)28(49-20(4)40)30(50-24)36-25(41)15-23(31(43)45-8)34-29(42)22(14-21-12-10-9-11-13-21)35-32(44)51-33(5,6)7/h9-13,22-24,26-28,30H,14-16H2,1-8H3,(H,34,42)(H,35,44)(H,36,41)/t22-,23-,24-,26+,27+,28-,30+/m0/s1 |
| InChIKey | XYGJXOAVUXCMOP-UNOKFMIESA-N |
| Literature Reference Author | C.COLOMBO,A.BERNARDI |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2011,3911(2011) |
| Literature Reference DOI | 10.1002/ejoc.201100124 |
| Molecular Weight | 723.731 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT21153 |