| SpectraBase Compound ID | INkbn7LScbM |
|---|---|
| InChI | InChI=1S/C30H46O16S2.2K/c1-14(2)9-22(32)44-25-24(46-48(39,40)41)23(45-47(36,37)38)20(13-31)43-28(25)42-17-10-18(27(34)35)19-7-8-30-11-16(15(3)26(30)33)5-6-21(30)29(19,4)12-17;;/h14,16-21,23-26,28,31,33H,3,5-13H2,1-2,4H3,(H,34,35)(H,36,37,38)(H,39,40,41);;/q;2*+1/p-2/t16-,17?,18-,19?,20+,21?,23+,24-,25+,26+,28+,29-,30-;;/m1../s1 |
| InChIKey | IUCNQFHEWLYECJ-DXMHUBNCSA-L |
| Mol Weight | 802.9826 g/mol |
| Molecular Formula | C30H44K2O16S2 |
| Exact Mass | 802.134491 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Dy04EpYg6vR |
|---|---|
| Name | ATRACTYLOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44K2O16S2 |
| InChI | InChI=1S/C30H46O16S2.2K/c1-14(2)9-22(32)44-25-24(46-48(39,40)41)23(45-47(36,37)38)20(13-31)43-28(25)42-17-10-18(27(34)35)19-7-8-30-11-16(15(3)26(30)33)5-6-21(30)29(19,4)12-17;;/h14,16-21,23-26,28,31,33H,3,5-13H2,1-2,4H3,(H,34,35)(H,36,37,38)(H,39,40,41);;/q;2*+1/p-2/t16-,17?,18-,19?,20+,21?,23+,24-,25+,26+,28+,29-,30-;;/m1../s1 |
| InChIKey | IUCNQFHEWLYECJ-DXMHUBNCSA-L |
| Literature Reference Author | C.D.SCHTEINGART,A.B.POMILIO |
| Literature Reference Citation | J.NAT.PROD.,47,1046(1984) |
| Literature Reference DOI | 10.1021/np50036a029 |
| Molecular Weight | 802.986 g/mol |
| Solvent | D2O |
| Source File Reference | UWCS3287 |