![#21;5-AMINO-3-OXAPENTYL_(SODIUM_[5-ACETAMIDO-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL]-ONATE)-(2->6)-(BETA-D-GALACTOPYRANOSYL)-(1->4)-2-ACETAMID](/api/spectrum/61GEgVe8tTb/structure.png?h=300&w=458 "#21;5-AMINO-3-OXAPENTYL_(SODIUM_[5-ACETAMIDO-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL]-ONATE)-(2->6)-(BETA-D-GALACTOPYRANOSYL)-(1->4)-2-ACETAMID")
| SpectraBase Compound ID | JrIfpGQspN |
|---|---|
| InChI | InChI=1S/C29H51N3O20.Na/c1-11(35)31-17-13(37)7-29(28(44)45,52-25(17)19(39)14(38)8-33)48-10-16-20(40)22(42)23(43)27(50-16)51-24-15(9-34)49-26(47-6-5-46-4-3-30)18(21(24)41)32-12(2)36;/h13-27,33-34,37-43H,3-10,30H2,1-2H3,(H,31,35)(H,32,36)(H,44,45);/q;+1/p-1/t13-,14?,15-,16+,17+,18-,19?,20+,21-,22+,23-,24-,25+,26-,27+,29+;/m1./s1 |
| InChIKey | MRZFNLUCLVWIMD-OGAQOBIZSA-M |
| Mol Weight | 783.7 g/mol |
| Molecular Formula | C29H50N3NaO20 |
| Exact Mass | 783.288535 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 61GEgVe8tTb |
|---|---|
| Name | #21;5-AMINO-3-OXAPENTYL_(SODIUM_[5-ACETAMIDO-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL]-ONATE)-(2->6)-(BETA-D-GALACTOPYRANOSYL)-(1->4)-2-ACETAMID |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H50N3NaO20 |
| InChI | InChI=1S/C29H51N3O20.Na/c1-11(35)31-17-13(37)7-29(28(44)45,52-25(17)19(39)14(38)8-33)48-10-16-20(40)22(42)23(43)27(50-16)51-24-15(9-34)49-26(47-6-5-46-4-3-30)18(21(24)41)32-12(2)36;/h13-27,33-34,37-43H,3-10,30H2,1-2H3,(H,31,35)(H,32,36)(H,44,45);/q;+1/p-1/t13-,14?,15-,16+,17+,18-,19?,20+,21-,22+,23-,24-,25+,26-,27+,29+;/m1./s1 |
| InChIKey | MRZFNLUCLVWIMD-OGAQOBIZSA-M |
| Literature Reference Author | S.FIGUEROA-PEREZ,V.VEREZ-BENCOMO |
| Literature Reference Citation | CARBOHYDR.RES.,317,29(1999) |
| Literature Reference DOI | 10.1016/S0008-6215(99)00022-1 |
| Molecular Weight | 783.714 g/mol |
| Solvent | D2O |