| SpectraBase Compound ID | GR9RHoG95hv |
|---|---|
| InChI | InChI=1S/C22H32O9S2.2Na/c1-20(2)9-5-10-21(3)18(20)8-11-22(4)19(21)12-14-15(13-29-22)17(31-33(26,27)28)7-6-16(14)30-32(23,24)25;;/h6-7,18-19H,5,8-13H2,1-4H3,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2/t18-,19?,21-,22+;;/m0../s1 |
| InChIKey | NDUIVWPHUKJTFJ-PEBJXBLCSA-L |
| Mol Weight | 548.57253856 g/mol |
| Molecular Formula | C22H30Na2O9S2 |
| Exact Mass | 548.112663 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KOk3EQ46lun |
|---|---|
| Name | BIS-(SULFATO)-CYCLOSIPHONODICTYOL-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30Na2O9S2 |
| InChI | InChI=1S/C22H32O9S2.2Na/c1-20(2)9-5-10-21(3)18(20)8-11-22(4)19(21)12-14-15(13-29-22)17(31-33(26,27)28)7-6-16(14)30-32(23,24)25;;/h6-7,18-19H,5,8-13H2,1-4H3,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2/t18-,19?,21-,22+;;/m0../s1 |
| InChIKey | NDUIVWPHUKJTFJ-PEBJXBLCSA-L |
| Literature Reference Author | K.B.KILLDAY,A.E.WRIGHT,R.H.JACKSON,M.A.SILLS |
| Literature Reference Citation | J.NAT.PROD.,58,958(1995) |
| Literature Reference DOI | 10.1021/np50120a024 |
| Molecular Weight | 548.574 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVP6518 |