![8-METHOXYCARBONYLOCTYL-4-O-(4-O-[2-ACETAMIDO-2-DEOXY-3-O-(BETA-D-GALACTOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-BETA-D-GALACTOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/FLTiVauV18e/structure.png?h=300&w=458 "8-METHOXYCARBONYLOCTYL-4-O-(4-O-[2-ACETAMIDO-2-DEOXY-3-O-(BETA-D-GALACTOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-BETA-D-GALACTOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | Bd8kTxdZfsf |
|---|---|
| InChI | InChI=1S/C42H63NO24/c1-59-24(48)12-6-4-2-3-5-9-13-60-40-32(55)29(52)35(22(16-46)63-40)66-42-33(56)30(53)34(23(17-47)64-42)65-39-25(43-37(57)18-10-7-8-11-19(18)38(43)58)36(27(50)21(15-45)61-39)67-41-31(54)28(51)26(49)20(14-44)62-41/h7-8,10-11,20-23,25-36,39-42,44-47,49-56H,2-6,9,12-17H2,1H3/t20-,21-,22+,23-,25-,26+,27+,28+,29+,30-,31-,32+,33-,34+,35+,36-,39+,40+,41+,42+/m1/s1 |
| InChIKey | PKMGKJPHTXQGFP-JXADEMHISA-N |
| Mol Weight | 965.9 g/mol |
| Molecular Formula | C42H63NO24 |
| Exact Mass | 965.374002 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FLTiVauV18e |
|---|---|
| Name | 8-METHOXYCARBONYLOCTYL-4-O-[4-O-(2-ACETAMIDO-2-DEOXY-3-O-(BETA-D-GALACTOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H63NO24 |
| InChI | InChI=1S/C42H63NO24/c1-59-24(48)12-6-4-2-3-5-9-13-60-40-32(55)29(52)35(22(16-46)63-40)66-42-33(56)30(53)34(23(17-47)64-42)65-39-25(43-37(57)18-10-7-8-11-19(18)38(43)58)36(27(50)21(15-45)61-39)67-41-31(54)28(51)26(49)20(14-44)62-41/h7-8,10-11,20-23,25-36,39-42,44-47,49-56H,2-6,9,12-17H2,1H3/t20-,21-,22+,23-,25-,26+,27+,28+,29+,30-,31-,32+,33-,34+,35+,36-,39+,40+,41+,42+/m1/s1 |
| InChIKey | PKMGKJPHTXQGFP-JXADEMHISA-N |
| Literature Reference Author | S.SABESAN,R.U.LEMIEUX |
| Literature Reference Citation | CAN.J.CHEM.,62,644(1984) |
| Literature Reference DOI | 10.1139/v84-108 |
| Molecular Weight | 965.955 g/mol |
| Solvent | D2O |
| Source File Reference | UWCS7894 |