| SpectraBase Compound ID | KNItOZ7PivE |
|---|---|
| InChI | InChI=1S/C40H47N3O14/c1-23(44)41-32-34(47)35-31(22-52-38(56-35)28-12-8-5-9-13-28)55-40(32)57-36-30(21-50-20-27-10-6-4-7-11-27)54-39(33(42-24(2)45)37(36)53-25(3)46)51-19-18-26-14-16-29(17-15-26)43(48)49/h4-17,30-40,47H,18-22H2,1-3H3,(H,41,44)(H,42,45)/t30-,31-,32-,33-,34-,35+,36+,37-,38+,39+,40+/m1/s1 |
| InChIKey | FVMQMRCWCMVQPW-FMKJGVEUSA-N |
| Mol Weight | 793.8 g/mol |
| Molecular Formula | C40H47N3O14 |
| Exact Mass | 793.305803 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I4XWNWf8dwl |
|---|---|
| Name | #15;2-(4-NITROPHENYL)-ETHYL-2-ACETAMIDO-4,6-O-BENZYLIDENE-2-DEOXY-BETA-D-GALACTOPYRANOSYL-(1->4)-2-ACETAMIDO-3-O-ACETYL-6-O-BENZYL-2-DEOXY-ALPHA-D-GALAC |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H47N3O14 |
| InChI | InChI=1S/C40H47N3O14/c1-23(44)41-32-34(47)35-31(22-52-38(56-35)28-12-8-5-9-13-28)55-40(32)57-36-30(21-50-20-27-10-6-4-7-11-27)54-39(33(42-24(2)45)37(36)53-25(3)46)51-19-18-26-14-16-29(17-15-26)43(48)49/h4-17,30-40,47H,18-22H2,1-3H3,(H,41,44)(H,42,45)/t30-,31-,32-,33-,34-,35+,36+,37-,38+,39+,40+/m1/s1 |
| InChIKey | FVMQMRCWCMVQPW-FMKJGVEUSA-N |
| Literature Reference Author | J.HANSSON,P.J.GAREGG,S.OSCARSON |
| Literature Reference Citation | J.ORG.CHEM.,66,6234(2001) |
| Literature Reference DOI | 10.1021/jo001302m |
| Molecular Weight | 793.825 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN24562 |