| SpectraBase Compound ID | EcSiC0IRL9C |
|---|---|
| InChI | InChI=1S/C49H53NO14S/c1-5-65-49-45(59-27-35-21-13-8-14-22-35)44(58-26-34-19-11-7-12-20-34)41(57-25-33-17-9-6-10-18-33)38(64-49)29-60-48-40(50-46(54)36-23-15-16-24-37(36)47(50)55)43(62-32(4)53)42(61-31(3)52)39(63-48)28-56-30(2)51/h6-24,38-45,48-49H,5,25-29H2,1-4H3/t38-,39+,40+,41-,42+,43+,44+,45-,48+,49+/m1/s1 |
| InChIKey | RJMZEGUVDKWLSX-BIWFTLRYSA-N |
| Mol Weight | 912.0 g/mol |
| Molecular Formula | C49H53NO14S |
| Exact Mass | 911.318677 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AmdPsCDHEuY |
|---|---|
| Name | ETHYL-2,3,4-TRI-O-BENZYL-6-O-(3,4,6-TRI-O-ACETYL-2-DEOXY-2-PHTHALIMIDO-BETA-D-GLUCOPYRANOSYL)-1-THIO-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H53NO14S |
| InChI | InChI=1S/C49H53NO14S/c1-5-65-49-45(59-27-35-21-13-8-14-22-35)44(58-26-34-19-11-7-12-20-34)41(57-25-33-17-9-6-10-18-33)38(64-49)29-60-48-40(50-46(54)36-23-15-16-24-37(36)47(50)55)43(62-32(4)53)42(61-31(3)52)39(63-48)28-56-30(2)51/h6-24,38-45,48-49H,5,25-29H2,1-4H3/t38-,39+,40+,41-,42+,43+,44+,45-,48+,49+/m1/s1 |
| InChIKey | RJMZEGUVDKWLSX-BIWFTLRYSA-N |
| Literature Reference Author | S.MEHTA,B.M.PINTO |
| Literature Reference Citation | J.ORG.CHEM.,58,3269(1993) |
| Literature Reference DOI | 10.1021/jo00064a012 |
| Molecular Weight | 912.018 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS22253 |