| SpectraBase Compound ID | BizyagR8CgK |
|---|---|
| InChI | InChI=1S/C35H44O21S/c1-15-10-12-24(13-11-15)57(44,45)56-33-31(51-21(7)41)29(50-20(6)40)28(49-19(5)39)30(32(33)52-22(8)42)55-35-34(53-23(9)43)27(48-18(4)38)26(47-17(3)37)25(54-35)14-46-16(2)36/h10-13,25-35H,14H2,1-9H3/t25-,26+,27+,28+,29+,30-,31-,32+,33+,34-,35+/m0/s1 |
| InChIKey | GAXVKAQKDJQTTG-BVLHPPBUSA-N |
| Mol Weight | 832.8 g/mol |
| Molecular Formula | C35H44O21S |
| Exact Mass | 832.20958 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2JxrmGYe6vS |
|---|---|
| Name | TETRA-O-ACETYL-3-O-(4-METHYLPHENYLSULFONYL)-1-O-(TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-SCYLLO-INOSITOL |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H44O21S |
| InChI | InChI=1S/C35H44O21S/c1-15-10-12-24(13-11-15)57(44,45)56-33-31(51-21(7)41)29(50-20(6)40)28(49-19(5)39)30(32(33)52-22(8)42)55-35-34(53-23(9)43)27(48-18(4)38)26(47-17(3)37)25(54-35)14-46-16(2)36/h10-13,25-35H,14H2,1-9H3/t25-,26+,27+,28+,29+,30-,31-,32+,33+,34-,35+/m0/s1 |
| InChIKey | GAXVKAQKDJQTTG-BVLHPPBUSA-N |
| Literature Reference Author | A.SCAFFIDI,R.V.STICK |
| Literature Reference Citation | AUSTR.J.CHEM.,59,894(2006) |
| Literature Reference DOI | 10.1071/CH06393 |
| Molecular Weight | 832.782 g/mol |
| Sample ID | 37710 |
| Solvent | Unknown |