| SpectraBase Compound ID | 4nwgGiGkprh |
|---|---|
| InChI | InChI=1S/C23H33NO13S.Na/c1-10(27)24-15-12(28)7-23(22(33)34,36-19(15)16(30)13(29)8-25)37-20-17(31)14(9-26)35-21(18(20)32)38-11-5-3-2-4-6-11;/h2-6,12-21,25-26,28-32H,7-9H2,1H3,(H,24,27)(H,33,34);/q;+1/p-1/t12-,13+,14-,15+,16+,17+,18-,19+,20+,21+,23-;/m0./s1 |
| InChIKey | JGJBSVMQMDVHGA-BHVQNZHXSA-M |
| Mol Weight | 585.6 g/mol |
| Molecular Formula | C23H32NNaO13S |
| Exact Mass | 585.149206 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AJshVobEB1q |
|---|---|
| Name | PHENYL-(5-ACETAMIDO-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL)-(2->3)-1-THIO-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H32NNaO13S |
| InChI | InChI=1S/C23H33NO13S.Na/c1-10(27)24-15-12(28)7-23(22(33)34,36-19(15)16(30)13(29)8-25)37-20-17(31)14(9-26)35-21(18(20)32)38-11-5-3-2-4-6-11;/h2-6,12-21,25-26,28-32H,7-9H2,1H3,(H,24,27)(H,33,34);/q;+1/p-1/t12-,13+,14-,15+,16+,17+,18-,19+,20+,21+,23-;/m0./s1 |
| InChIKey | JGJBSVMQMDVHGA-BHVQNZHXSA-M |
| Literature Reference Author | S.MEHTA,M.GILBERT,W.W.WAKARCHUK,D.M.WHITFIELD |
| Literature Reference Citation | ORG.LETTERS,2,751(2000) |
| Literature Reference DOI | 10.1021/ol990406k |
| Molecular Weight | 585.556 g/mol |
| Solvent | D2O |
| Source File Reference | UWLU33355 |