| SpectraBase Compound ID | CHNTiDVmB2W |
|---|---|
| InChI | InChI=1S/C25H45N3O16.ClH/c1-9(32)27-14-21(17(35)12(7-30)40-23(14)39-5-3-4-26)43-24-15(28-10(2)33)22(18(36)13(8-31)41-24)44-25-20(38)19(37)16(34)11(6-29)42-25;/h11-25,29-31,34-38H,3-8,26H2,1-2H3,(H,27,32)(H,28,33);1H/t11-,12-,13-,14-,15-,16+,17+,18-,19+,20-,21-,22-,23+,24+,25+;/m1./s1 |
| InChIKey | KUNZMOPQHHKTIM-XKPMHECUSA-N |
| Mol Weight | 680.1 g/mol |
| Molecular Formula | C25H46ClN3O16 |
| Exact Mass | 679.25666 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2TmBiVt80wB |
|---|---|
| Name | #7;3-AZIDOPROPYL-BETA-D-GALACTOPYRANOSYL-(1->3)-2-DEOXY-2-ACETAMIDO-BETA-D-GLUCOPYRANOSYL-(1->3)-2-DEOXY-2-ACETAMIDO-ALPHA-D-GALACTOPYRANOSIDE-HYDROCHLORIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H46ClN3O16 |
| InChI | InChI=1S/C25H45N3O16.ClH/c1-9(32)27-14-21(17(35)12(7-30)40-23(14)39-5-3-4-26)43-24-15(28-10(2)33)22(18(36)13(8-31)41-24)44-25-20(38)19(37)16(34)11(6-29)42-25;/h11-25,29-31,34-38H,3-8,26H2,1-2H3,(H,27,32)(H,28,33);1H/t11-,12-,13-,14-,15-,16+,17+,18-,19+,20-,21-,22-,23+,24+,25+;/m1./s1 |
| InChIKey | KUNZMOPQHHKTIM-XKPMHECUSA-N |
| Literature Reference Author | D.BENITO-ALIFONSO,R.A.JONES,A.T.TRAN,H.WOODWARD,N.SMITH,M.V. GALAN |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,9,1867(2013) |
| Literature Reference DOI | 10.3762/bjoc.9.218 |
| Molecular Weight | 680.104 g/mol |
| Solvent | D2O |
| Source File Reference | UWLU77521 |