![8-METHOXYCARBONYLOCTYL-4-O-(ALPHA-L-FUCOPYRANOSYL)-3-O-[2-O-(ALPHA-L-FUCOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-2-N-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/1l5u0tfx4CB/structure.png?h=300&w=458 "8-METHOXYCARBONYLOCTYL-4-O-(ALPHA-L-FUCOPYRANOSYL)-3-O-[2-O-(ALPHA-L-FUCOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-2-N-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | EYjriQzX56q |
|---|---|
| InChI | InChI=1S/C36H63NO21/c1-15-22(42)25(45)28(48)34(52-15)56-30-19(14-39)55-33(51-12-10-8-6-5-7-9-11-20(41)50-4)21(37-17(3)40)31(30)57-36-32(27(47)24(44)18(13-38)54-36)58-35-29(49)26(46)23(43)16(2)53-35/h15-16,18-19,21-36,38-39,42-49H,5-14H2,1-4H3,(H,37,40)/t15-,16+,18+,19-,21-,22+,23-,24-,25+,26-,27-,28-,29+,30+,31-,32+,33-,34+,35-,36-/m0/s1 |
| InChIKey | SPMVUZNAHMSIDA-JTHAPCKXSA-N |
| Mol Weight | 845.9 g/mol |
| Molecular Formula | C36H63NO21 |
| Exact Mass | 845.389258 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1l5u0tfx4CB |
|---|---|
| Name | 8-METHOXYCARBONYLOCTYL-4-O-(ALPHA-L-FUCOPYRANOSYL)-3-O-[2-O-(ALPHA-L-FUCOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-2-N-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H63NO21 |
| InChI | InChI=1S/C36H63NO21/c1-15-22(42)25(45)28(48)34(52-15)56-30-19(14-39)55-33(51-12-10-8-6-5-7-9-11-20(41)50-4)21(37-17(3)40)31(30)57-36-32(27(47)24(44)18(13-38)54-36)58-35-29(49)26(46)23(43)16(2)53-35/h15-16,18-19,21-36,38-39,42-49H,5-14H2,1-4H3,(H,37,40)/t15-,16+,18+,19-,21-,22+,23-,24-,25+,26-,27-,28-,29+,30+,31-,32+,33-,34+,35-,36-/m0/s1 |
| InChIKey | SPMVUZNAHMSIDA-JTHAPCKXSA-N |
| Literature Reference Author | R.U.LEMIEUX,K.BOCK,L.T.J.DELBAERE,S.KOTO,V.S.RAO |
| Literature Reference Citation | CAN.J.CHEM.,58,631(1980) |
| Literature Reference DOI | 10.1139/v80-098 |
| Molecular Weight | 845.890 g/mol |
| Solvent | D2O |
| Source File Reference | UWCS8547 |