| SpectraBase Compound ID | 8iuv7BzV8Su |
|---|---|
| InChI | InChI=1S/C48H78O19/c1-43(2)14-15-48(20-62-40-33(56)31(54)29(52)23(18-49)63-40)22(16-43)21-8-9-26-45(5)12-11-28(44(3,4)25(45)10-13-46(26,6)47(21,7)17-27(48)51)65-42-36(59)37(35(58)38(67-42)39(60)61)66-41-34(57)32(55)30(53)24(19-50)64-41/h8,22-38,40-42,49-59H,9-20H2,1-7H3,(H,60,61)/t22-,23+,24+,25-,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36+,37-,38-,40+,41-,42+,45-,46+,47+,48+/m0/s1 |
| InChIKey | NHWXFBDPNVQJDT-ZIDASNGGSA-N |
| Mol Weight | 959.1 g/mol |
| Molecular Formula | C48H78O19 |
| Exact Mass | 958.51373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DwCpxujdnrC |
|---|---|
| Name | ALTERNOSIDE-IX;LONGISPINOGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL-28-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O19 |
| InChI | InChI=1S/C48H78O19/c1-43(2)14-15-48(20-62-40-33(56)31(54)29(52)23(18-49)63-40)22(16-43)21-8-9-26-45(5)12-11-28(44(3,4)25(45)10-13-46(26,6)47(21,7)17-27(48)51)65-42-36(59)37(35(58)38(67-42)39(60)61)66-41-34(57)32(55)30(53)24(19-50)64-41/h8,22-38,40-42,49-59H,9-20H2,1-7H3,(H,60,61)/t22-,23+,24+,25-,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36+,37-,38-,40+,41-,42+,45-,46+,47+,48+/m0/s1 |
| InChIKey | NHWXFBDPNVQJDT-ZIDASNGGSA-N |
| Literature Reference Author | K.YOSHIKAWA,H.OGATA,S.ARIHARA,H.C.CHANG,J.D.WANG |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,1102(1998) |
| Literature Reference DOI | 10.1248/cpb.46.1102 |
| Molecular Weight | 959.136 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS6575 |