| SpectraBase Compound ID | DgeStIBmUBa |
|---|---|
| InChI | InChI=1S/C16H27NO12.N/c1-2-3-28-16(15(24)25)13(23)10(21)9(20)12(29-16)7(18)5-27-14-11(22)8(19)6(17)4-26-14;/h2,6-14,18-23H,1,3-5,17H2,(H,24,25);/q;+1/p-1/t6-,7+,8-,9+,10-,11+,12+,13-,14+,16+;/m0./s1 |
| InChIKey | YIQCLRPLJCATRJ-MCQPPTIBSA-M |
| Mol Weight | 438.39 g/mol |
| Molecular Formula | C16H26N2O12 |
| Exact Mass | 438.148574 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7nMLQPS8gJB |
|---|---|
| Name | AMMONIUM-4-AMINO-4-DEOXY-BETA-L-ARABINOPYRANOSYL-(1->8)-(ALLYL-D-GLYCERO-ALPHA-D-TALO-OCT-2-ULOPYRANOSIDE)-ONATE |
| Compound Number | 32 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H26N2O12 |
| InChI | InChI=1S/C16H27NO12.N/c1-2-3-28-16(15(24)25)13(23)10(21)9(20)12(29-16)7(18)5-27-14-11(22)8(19)6(17)4-26-14;/h2,6-14,18-23H,1,3-5,17H2,(H,24,25);/q;+1/p-1/t6-,7+,8-,9+,10-,11+,12+,13-,14+,16+;/m0./s1 |
| InChIKey | YIQCLRPLJCATRJ-MCQPPTIBSA-M |
| Literature Reference Author | M.BLAUKOPF,B.MUELLER,A.HOFINGER,P.KOSMA |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2012,119(2012) |
| Literature Reference DOI | 10.1002/ejoc.201101171 |
| Molecular Weight | 438.389 g/mol |
| Solvent | D2O |
| Source File Reference | UWLU83362 |