| SpectraBase Compound ID | 9vWGikaAY2T |
|---|---|
| InChI | InChI=1S/C54H51NO10S/c1-35-45(58-31-36-19-7-2-8-20-36)48(59-32-37-21-9-3-10-22-37)49(60-33-38-23-11-4-12-24-38)53(62-35)65-47-44(55-50(56)41-29-17-18-30-42(41)51(55)57)54(66-40-27-15-6-16-28-40)63-43-34-61-52(64-46(43)47)39-25-13-5-14-26-39/h2-30,35,43-49,52-54H,31-34H2,1H3/t35-,43+,44+,45+,46+,47+,48+,49-,52+,53-,54-/m1/s1 |
| InChIKey | WDDYVDHDZMOOGM-BOYBPUECSA-N |
| Mol Weight | 906.1 g/mol |
| Molecular Formula | C54H51NO10S |
| Exact Mass | 905.323368 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 74t5nBLNT39 |
|---|---|
| Name | PHENYL-2,3,4-TRI-O-BENZYL-ALPHA-L-FUCOPYRANOSYL-(1->3)-4,6-O-BENZYLIDENE-2-DEOXY-2-PHTHALIMIDO-1-THIO-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H51NO10S |
| InChI | InChI=1S/C54H51NO10S/c1-35-45(58-31-36-19-7-2-8-20-36)48(59-32-37-21-9-3-10-22-37)49(60-33-38-23-11-4-12-24-38)53(62-35)65-47-44(55-50(56)41-29-17-18-30-42(41)51(55)57)54(66-40-27-15-6-16-28-40)63-43-34-61-52(64-46(43)47)39-25-13-5-14-26-39/h2-30,35,43-49,52-54H,31-34H2,1H3/t35-,43+,44+,45+,46+,47+,48+,49-,52+,53-,54-/m1/s1 |
| InChIKey | WDDYVDHDZMOOGM-BOYBPUECSA-N |
| Literature Reference Author | J.WATTS,J.JIMENEZ-BARBERO,A.POVEDA,T.B.GRINDLEY |
| Literature Reference Citation | CAN.J.CHEM.,81,364(2003) |
| Literature Reference DOI | 10.1139/v03-062 |
| Molecular Weight | 906.060 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU29988 |