| SpectraBase Compound ID | 7ib9S0V5pZd |
|---|---|
| InChI | InChI=1S/C48H82O19/c1-21(9-13-31(45(4,5)61)67-43-40(60)37(57)34(54)27(65-43)20-62-41-38(58)35(55)32(52)25(18-49)63-41)22-15-16-46(6)28-12-10-23-24(48(28,8)29(51)17-47(22,46)7)11-14-30(44(23,2)3)66-42-39(59)36(56)33(53)26(19-50)64-42/h10,21-22,24-43,49-61H,9,11-20H2,1-8H3/t21?,22?,24-,25+,26-,27+,28+,29?,30+,31-,32+,33-,34+,35-,36+,37-,38+,39-,40+,41-,42+,43-,46?,47?,48?/m1/s1 |
| InChIKey | KYVIPFHNYCKOMQ-TYBDBNIFSA-N |
| Mol Weight | 963.2 g/mol |
| Molecular Formula | C48H82O19 |
| Exact Mass | 962.54503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6xNT7r0oJ3E |
|---|---|
| Name | 3-O-BETA-D-GLUCOPYRANOSYL-OXOMOGROL-24-O-ALPHA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H82O19 |
| InChI | InChI=1S/C48H82O19/c1-21(9-13-31(45(4,5)61)67-43-40(60)37(57)34(54)27(65-43)20-62-41-38(58)35(55)32(52)25(18-49)63-41)22-15-16-46(6)28-12-10-23-24(48(28,8)29(51)17-47(22,46)7)11-14-30(44(23,2)3)66-42-39(59)36(56)33(53)26(19-50)64-42/h10,21-22,24-43,49-61H,9,11-20H2,1-8H3/t21?,22?,24-,25+,26-,27+,28+,29?,30+,31-,32+,33-,34+,35-,36+,37-,38+,39-,40+,41-,42+,43-,46?,47?,48?/m1/s1 |
| InChIKey | KYVIPFHNYCKOMQ-TYBDBNIFSA-N |
| Literature Reference Author | L.WANG,Z.YANG,F.LU,J.LIU,Y.SONG,D.LI |
| Literature Reference Citation | MOLECULES,19,12676(2014) |
| Literature Reference DOI | 10.3390/molecules190812676 |
| Molecular Weight | 963.168 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWIR15090 |