| SpectraBase Compound ID | FgMY8hLpLv4 |
|---|---|
| InChI | InChI=1S/C29H45N3O14/c1-29(2,3)46-28(41)31-12-16-19(34)22(37)23(38)24(44-16)25(39)32-18-21(36)20(35)17(13-33)45-26(18)42-11-7-10-30-27(40)43-14-15-8-5-4-6-9-15/h4-6,8-9,16-24,26,33-38H,7,10-14H2,1-3H3,(H,30,40)(H,31,41)(H,32,39)/t16-,17+,18+,19-,20+,21+,22+,23+,24-,26+/m0/s1 |
| InChIKey | AZRXMVJQKKALQU-NKJISQEGSA-N |
| Mol Weight | 659.7 g/mol |
| Molecular Formula | C29H45N3O14 |
| Exact Mass | 659.290153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J2sSgSzrH35 |
|---|---|
| Name | 3-BENZYLOXYCARBONYLAMINOPROPYL-2-DEOXY-2-(1-DEOXY-1-TERT.-BUTOXYCARBONYLAMINOMETHYL-BETA-D-GALACTOHEXOPYRANOSYLURONAMIDE)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 5K |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H45N3O14 |
| InChI | InChI=1S/C29H45N3O14/c1-29(2,3)46-28(41)31-12-16-19(34)22(37)23(38)24(44-16)25(39)32-18-21(36)20(35)17(13-33)45-26(18)42-11-7-10-30-27(40)43-14-15-8-5-4-6-9-15/h4-6,8-9,16-24,26,33-38H,7,10-14H2,1-3H3,(H,30,40)(H,31,41)(H,32,39)/t16-,17+,18+,19-,20+,21+,22+,23+,24-,26+/m0/s1 |
| InChIKey | AZRXMVJQKKALQU-NKJISQEGSA-N |
| Literature Reference Author | O.SCHWARDT,G.BAISCH,R.OEHRLEIN |
| Literature Reference Citation | BIOORG.MED.CHEM.,9,1857(2001) |
| Literature Reference DOI | 10.1016/S0968-0896(01)00086-4 |
| Molecular Weight | 659.688 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS21990 |