| SpectraBase Compound ID | GH1dH4cwHSp |
|---|---|
| InChI | InChI=1S/C39H52O21/c1-17-28(45)31(48)36(56-18(2)41)39(55-17)60-35-33(50)38(53-12-11-20-6-9-23(51-3)22(43)13-20)58-26(16-54-37-32(49)30(47)29(46)25(15-40)57-37)34(35)59-27(44)10-7-19-5-8-21(42)24(14-19)52-4/h5-10,13-14,17,25-26,28-40,42-43,45-50H,11-12,15-16H2,1-4H3/b10-7+/t17-,25+,26-,28-,29+,30-,31+,32+,33-,34-,35-,36+,37+,38-,39-/m0/s1 |
| InChIKey | XQYGNOFIONAZIJ-AMFYCUSJSA-N |
| Mol Weight | 856.8 g/mol |
| Molecular Formula | C39H52O21 |
| Exact Mass | 856.300109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LMHpLvCntZV |
|---|---|
| Name | UNRANOSIDE-A;R-2-O-ACETYL-GLUCOPYRANOSYL-(1->6)-MARTYNOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H52O21 |
| InChI | InChI=1S/C39H52O21/c1-17-28(45)31(48)36(56-18(2)41)39(55-17)60-35-33(50)38(53-12-11-20-6-9-23(51-3)22(43)13-20)58-26(16-54-37-32(49)30(47)29(46)25(15-40)57-37)34(35)59-27(44)10-7-19-5-8-21(42)24(14-19)52-4/h5-10,13-14,17,25-26,28-40,42-43,45-50H,11-12,15-16H2,1-4H3/b10-7+/t17-,25+,26-,28-,29+,30-,31+,32+,33-,34-,35-,36+,37+,38-,39-/m0/s1 |
| InChIKey | XQYGNOFIONAZIJ-AMFYCUSJSA-N |
| Literature Reference Author | H.OTSUKA |
| Literature Reference Citation | PHYTOCHEM.,32,979(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85239-N |
| Molecular Weight | 856.829 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU6278 |