| SpectraBase Compound ID | 3y9IOgo5nqO |
|---|---|
| InChI | InChI=1S/C30H44O22S4/c31-1-5-9(35)13(39)17(43)27(49-5)53-23-21(47)25(55-29-19(45)15(41)11(37)7(3-33)51-29)26(56-30-20(46)16(42)12(38)8(4-34)52-30)22(48)24(23)54-28-18(44)14(40)10(36)6(2-32)50-28/h5-20,27-46H,1-4H2/t5-,6-,7-,8+,9-,10-,11-,12+,13+,14+,15+,16-,17-,18-,19-,20+,27+,28+,29+,30-/m1/s1 |
| InChIKey | UJVBRJDMXBPQLI-DOBNNEKISA-N |
| Mol Weight | 884.9 g/mol |
| Molecular Formula | C30H44O22S4 |
| Exact Mass | 884.120708 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CXxYjlX2lAP |
|---|---|
| Name | 2,3,5,6-TETRAKIS-(BETA-D-GLUCOPYRANOSYLTHIO)-BENZO-1,4-QUINONE |
| Compound Number | 40 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O22S4 |
| InChI | InChI=1S/C30H44O22S4/c31-1-5-9(35)13(39)17(43)27(49-5)53-23-21(47)25(55-29-19(45)15(41)11(37)7(3-33)51-29)26(56-30-20(46)16(42)12(38)8(4-34)52-30)22(48)24(23)54-28-18(44)14(40)10(36)6(2-32)50-28/h5-20,27-46H,1-4H2/t5-,6-,7-,8+,9-,10-,11-,12+,13+,14+,15+,16-,17-,18-,19-,20+,27+,28+,29+,30-/m1/s1 |
| InChIKey | UJVBRJDMXBPQLI-DOBNNEKISA-N |
| Literature Reference Author | M.SCHNABELRAUCH,A.VASELLA,S.G.WITHERS |
| Literature Reference Citation | HELV.CHIM.ACTA,77,778(1994) |
| Literature Reference DOI | 10.1002/hlca.19940770319 |
| Molecular Weight | 884.906 g/mol |
| Solvent | D2O |
| Source File Reference | UWSK2913 |