| SpectraBase Compound ID | 2ag5wurXHv5 |
|---|---|
| InChI | InChI=1S/C28H40O10S/c1-13-10-19(36-24(30)14(13)2)15(3)27(31)9-7-17-21-18(6-8-25(17,27)4)26(5)20(29)11-16(38-39(33,34)35)12-28(26,32)23-22(21)37-23/h15-19,21-23,31-32H,6-12H2,1-5H3,(H,33,34,35)/t15-,16+,17+,18+,19?,21+,22+,23+,25+,26+,27+,28+/m1/s1 |
| InChIKey | UPDQBLXDBCLBFJ-ZOLJUIFESA-N |
| Mol Weight | 568.7 g/mol |
| Molecular Formula | C28H40O10S |
| Exact Mass | 568.234219 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lx70sZBpXQZ |
|---|---|
| Name | 2,3-DIHYDRO-WITHANONE-3-BETA-O-SULFATE;5-ALPHA,17-ALPHA-DIHYDROXY-6-ALPHA,7-ALPHA-EPOXY-1-OXO-3-BETA-O-SULFATE-WITHA-24-ENOLIDE |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O10S |
| InChI | InChI=1S/C28H40O10S/c1-13-10-19(36-24(30)14(13)2)15(3)27(31)9-7-17-21-18(6-8-25(17,27)4)26(5)20(29)11-16(38-39(33,34)35)12-28(26,32)23-22(21)37-23/h15-19,21-23,31-32H,6-12H2,1-5H3,(H,33,34,35)/t15-,16+,17+,18+,19?,21+,22+,23+,25+,26+,27+,28+/m1/s1 |
| InChIKey | UPDQBLXDBCLBFJ-ZOLJUIFESA-N |
| Literature Reference Author | L.MISRA,P.LAL,R.S.SANGWAN,N.S.SANGWAN,G.C.UNIYAL,R.TULI |
| Literature Reference Citation | PHYTOCHEM.,66,2702(2005) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.10.001 |
| Molecular Weight | 568.680 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ19766 |