| SpectraBase Compound ID | IeDaSUTnbW4 |
|---|---|
| InChI | InChI=1S/C29H36O11/c1-14(7-16-8-15(2)23(33)36-16)22(32)24(3)5-6-26-12-27-19(10-20(31)39-27)38-25(4,13-30)21(27)17-9-18(26)29(35,37-17)28(34,11-24)40-26/h7-8,14,17-19,21,30,34-35H,5-6,9-13H2,1-4H3/b16-7-/t14-,17+,18-,19-,21+,24+,25+,26+,27+,28-,29-/m1/s1 |
| InChIKey | PAMIYNCDAXEJEB-PNLIEAEMSA-N |
| Mol Weight | 560.6 g/mol |
| Molecular Formula | C29H36O11 |
| Exact Mass | 560.225762 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lcs7xxEXN1l |
|---|---|
| Name | SCHICAGENIN-C |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H36O11 |
| InChI | InChI=1S/C29H36O11/c1-14(7-16-8-15(2)23(33)36-16)22(32)24(3)5-6-26-12-27-19(10-20(31)39-27)38-25(4,13-30)21(27)17-9-18(26)29(35,37-17)28(34,11-24)40-26/h7-8,14,17-19,21,30,34-35H,5-6,9-13H2,1-4H3/b16-7-/t14-,17+,18-,19-,21+,24+,25+,26+,27+,28-,29-/m1/s1 |
| InChIKey | PAMIYNCDAXEJEB-PNLIEAEMSA-N |
| Literature Reference Author | J.R.WANG,T.KURTAN,A.MANDI,Y.W.GUO |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2012,5471(2012) |
| Literature Reference DOI | 10.1002/ejoc.201200557 |
| Molecular Weight | 560.598 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU83836 |