| SpectraBase Compound ID | CcuagSYjCOQ |
|---|---|
| InChI | InChI=1S/C48H51NO9S/c1-32-41(51-28-34-18-8-3-9-19-34)44(52-29-35-20-10-4-11-21-35)45(53-30-36-22-12-5-13-23-36)47(55-32)58-43-40(49-33(2)50)48(59-38-26-16-7-17-27-38)56-39-31-54-46(57-42(39)43)37-24-14-6-15-25-37/h3-27,32,39-48H,28-31H2,1-2H3,(H,49,50)/t32-,39-,40-,41+,42-,43-,44+,45-,46-,47-,48+/m1/s1 |
| InChIKey | UPEJZEVGJPJCBS-KVZWSPIMSA-N |
| Mol Weight | 818.0 g/mol |
| Molecular Formula | C48H51NO9S |
| Exact Mass | 817.328453 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5HS9dhXJKUe |
|---|---|
| Name | PHENYL-2,3,4-TRI-O-BENZYL-ALPHA-L-FUCOPYRANOSYL-(1->3)-2-ACETAMIDO-4,6-O-BENZYLIDENE-2-DEOXY-1-THIO-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H51NO9S |
| InChI | InChI=1S/C48H51NO9S/c1-32-41(51-28-34-18-8-3-9-19-34)44(52-29-35-20-10-4-11-21-35)45(53-30-36-22-12-5-13-23-36)47(55-32)58-43-40(49-33(2)50)48(59-38-26-16-7-17-27-38)56-39-31-54-46(57-42(39)43)37-24-14-6-15-25-37/h3-27,32,39-48H,28-31H2,1-2H3,(H,49,50)/t32-,39-,40-,41+,42-,43-,44+,45-,46-,47-,48+/m1/s1 |
| InChIKey | UPEJZEVGJPJCBS-KVZWSPIMSA-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 | 817.994 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU29991 |