| SpectraBase Compound ID | 8jAEUXhZLQf |
|---|---|
| InChI | InChI=1S/C47H47NO10S/c1-30-40(53-27-31-16-6-2-7-17-31)42(54-28-32-18-8-3-9-19-32)43(55-29-33-20-10-4-11-21-33)46(56-30)58-41-38(48-44(51)35-24-14-15-25-36(35)45(48)52)47(57-37(26-49)39(41)50)59-34-22-12-5-13-23-34/h2-25,30,37-43,46-47,49-50H,26-29H2,1H3/t30-,37+,38+,39+,40+,41+,42+,43-,46-,47-/m1/s1 |
| InChIKey | XFWWRKXVEXWDLW-JFXINEGDSA-N |
| Mol Weight | 817.9 g/mol |
| Molecular Formula | C47H47NO10S |
| Exact Mass | 817.292068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GPn6p40y7nw |
|---|---|
| Name | PHENYL-2,3,4-TRI-O-BENZYL-ALPHA-L-FUCOPYRANOSYL-(1->3)-2-DEOXY-2-PHTHALIMIDO-1-THIO-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H47NO10S |
| InChI | InChI=1S/C47H47NO10S/c1-30-40(53-27-31-16-6-2-7-17-31)42(54-28-32-18-8-3-9-19-32)43(55-29-33-20-10-4-11-21-33)46(56-30)58-41-38(48-44(51)35-24-14-15-25-36(35)45(48)52)47(57-37(26-49)39(41)50)59-34-22-12-5-13-23-34/h2-25,30,37-43,46-47,49-50H,26-29H2,1H3/t30-,37+,38+,39+,40+,41+,42+,43-,46-,47-/m1/s1 |
| InChIKey | XFWWRKXVEXWDLW-JFXINEGDSA-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 | 817.951 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU29990 |