| SpectraBase Compound ID | Ls24M6gjD5M |
|---|---|
| InChI | InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m0/s1 |
| InChIKey | CSKKDSFETGLMSB-DAPNGDDTSA-N |
| Mol Weight | 388.37 g/mol |
| Molecular Formula | C17H24O10 |
| Exact Mass | 388.136947 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JQQdQaZf6WD |
|---|---|
| Name | SECOLOGANIN |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H24O10 |
| InChI | InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m0/s1 |
| InChIKey | CSKKDSFETGLMSB-DAPNGDDTSA-N |
| Literature Reference Author | A.PATTHY-LUKATS,A.KOCSIS,L.F.SZABO,B.PODANYI |
| Literature Reference Citation | J.NAT.PROD.,62,1492(1999) |
| Literature Reference DOI | 10.1021/np990150r |
| Molecular Weight | 388.372 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWRU556 |