| SpectraBase Compound ID | 3uDOXSQvoR5 |
|---|---|
| InChI | InChI=1S/C47H76O20/c1-19-28(54)31(57)33(59)38(63-19)65-35-29(55)24(52)17-62-40(35)67-41(61)47-11-10-42(2,3)12-21(47)20-8-9-26-43(4)13-23(51)37(66-39-34(60)32(58)30(56)25(16-48)64-39)44(5,18-49)36(43)22(50)14-46(26,7)45(20,6)15-27(47)53/h8,19,21-40,48-60H,9-18H2,1-7H3/t19-,21?,22+,23-,24-,25+,26?,27+,28-,29-,30+,31+,32-,33+,34+,35+,36?,37-,38-,39-,40-,43+,44-,45+,46+,47+/m0/s1 |
| InChIKey | SLIQSJBOWMXTRI-XEHMHIAPSA-N |
| Mol Weight | 961.1 g/mol |
| Molecular Formula | C47H76O20 |
| Exact Mass | 960.492995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Bk1AkqSaQs |
|---|---|
| Name | MIMUSOPSIDE-B;3-O-BETA-D-GLUCOPYRANOSYL-16-ALPHA-HYDROXY-PROTOBASSIC-ACID-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O20 |
| InChI | InChI=1S/C47H76O20/c1-19-28(54)31(57)33(59)38(63-19)65-35-29(55)24(52)17-62-40(35)67-41(61)47-11-10-42(2,3)12-21(47)20-8-9-26-43(4)13-23(51)37(66-39-34(60)32(58)30(56)25(16-48)64-39)44(5,18-49)36(43)22(50)14-46(26,7)45(20,6)15-27(47)53/h8,19,21-40,48-60H,9-18H2,1-7H3/t19-,21?,22+,23-,24-,25+,26?,27+,28-,29-,30+,31+,32-,33+,34+,35+,36?,37-,38-,39-,40-,43+,44-,45+,46+,47+/m0/s1 |
| InChIKey | SLIQSJBOWMXTRI-XEHMHIAPSA-N |
| Literature Reference Author | N.P.SAHU |
| Literature Reference Citation | PHYTOCHEM.,41,883(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00690-7 |
| Molecular Weight | 961.108 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU4106 |