| SpectraBase Compound ID | 8G1IeM5kRKQ |
|---|---|
| InChI | InChI=1S/C22H36O12/c1-9-3-4-11(12(9)5-23)10(2)7-31-21-20(30)18(28)16(26)14(34-21)8-32-22-19(29)17(27)15(25)13(6-24)33-22/h5,7,9,11-22,24-30H,3-4,6,8H2,1-2H3/b10-7+/t9-,11+,12-,13-,14+,15-,16+,17+,18-,19-,20+,21+,22-/m0/s1 |
| InChIKey | AODUJYFIWCUBMU-BWTHRKOPSA-N |
| Mol Weight | 492.5 g/mol |
| Molecular Formula | C22H36O12 |
| Exact Mass | 492.220677 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dj4793oTjLV |
|---|---|
| Name | IRIDODIALO-BETA-D-GENTIOBIOSIDE |
| Compound Number | 89 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H36O12 |
| InChI | InChI=1S/C22H36O12/c1-9-3-4-11(12(9)5-23)10(2)7-31-21-20(30)18(28)16(26)14(34-21)8-32-22-19(29)17(27)15(25)13(6-24)33-22/h5,7,9,11-22,24-30H,3-4,6,8H2,1-2H3/b10-7+/t9-,11+,12-,13-,14+,15-,16+,17+,18-,19-,20+,21+,22-/m0/s1 |
| InChIKey | AODUJYFIWCUBMU-BWTHRKOPSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,54,1173(1991) |
| Literature Reference DOI | 10.1021/np50077a001 |
| Molecular Weight | 492.521 g/mol |
| Solvent | D2O |
| Source File Reference | UWCS4454 |