| SpectraBase Compound ID | 3uaOgdOo9V5 |
|---|---|
| InChI | InChI=1S/C52H74O20/c1-25-14-19-51(62-22-25)26(2)52(71-33(9)59)41(72-51)21-38-36-13-12-34-20-35(15-17-49(34,10)37(36)16-18-50(38,52)11)68-48-46(67-32(8)58)44(65-30(6)56)42(40(69-48)23-60-27(3)53)70-47-45(66-31(7)57)43(64-29(5)55)39(24-61-47)63-28(4)54/h12,25-26,35-48H,13-24H2,1-11H3/t25-,26+,35-,36+,37-,38-,39+,40+,41-,42+,43+,44-,45-,46+,47+,48+,49-,50-,51+,52+/m0/s1 |
| InChIKey | UYJWPHBFSZLQID-VIXVTHODSA-N |
| Mol Weight | 1019.1 g/mol |
| Molecular Formula | C52H74O20 |
| Exact Mass | 1018.477345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LD7uOBy48os |
|---|---|
| Name | PENNOGENIN-3-O-ALPHA-L-ARABINOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSID-PERACETATE |
| Compound Number | 94 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H74O20 |
| InChI | InChI=1S/C52H74O20/c1-25-14-19-51(62-22-25)26(2)52(71-33(9)59)41(72-51)21-38-36-13-12-34-20-35(15-17-49(34,10)37(36)16-18-50(38,52)11)68-48-46(67-32(8)58)44(65-30(6)56)42(40(69-48)23-60-27(3)53)70-47-45(66-31(7)57)43(64-29(5)55)39(24-61-47)63-28(4)54/h12,25-26,35-48H,13-24H2,1-11H3/t25-,26+,35-,36+,37-,38-,39+,40+,41-,42+,43+,44-,45-,46+,47+,48+,49-,50-,51+,52+/m0/s1 |
| InChIKey | UYJWPHBFSZLQID-VIXVTHODSA-N |
| Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,R.K.GUPTA,R.S.THAKUR |
| Literature Reference Citation | PHYTOCHEM.,24,2479(1985) |
| Literature Reference DOI | 10.1016/S0031-9422(00)80653-6 |
| Molecular Weight | 1019.148 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW17137 |