| SpectraBase Compound ID | 9nsKGmHw931 |
|---|---|
| InChI | InChI=1S/C18H22O11S/c1-30-18(24)26-4-6-2-8-11-7(15(23)27-8)5-25-16(10(6)11)29-17-14(22)13(21)12(20)9(3-19)28-17/h2,5,8-14,16-17,19-22H,3-4H2,1H3/t8-,9?,10?,11?,12?,13?,14?,16-,17?/m0/s1 |
| InChIKey | OJISWUQNQQWEND-VKQBUWJFSA-N |
| Mol Weight | 446.42 g/mol |
| Molecular Formula | C18H22O11S |
| Exact Mass | 446.088283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Jkjcv9RP6E |
|---|---|
| Name | PAEDEROSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H22O11S |
| InChI | InChI=1S/C18H22O11S/c1-30-18(24)26-4-6-2-8-11-7(15(23)27-8)5-25-16(10(6)11)29-17-14(22)13(21)12(20)9(3-19)28-17/h2,5,8-14,16-17,19-22H,3-4H2,1H3/t8-,9?,10?,11?,12?,13?,14?,16-,17?/m0/s1 |
| InChIKey | OJISWUQNQQWEND-VKQBUWJFSA-N |
| Literature Reference Author | I.CALIS,J.HEILMANN,D.TASDEMIR,A.LINDEN,C.M.IRELAND,O.STICHER |
| Literature Reference Citation | J.NAT.PROD.,64,961(2001) |
| Literature Reference DOI | 10.1021/np000614h |
| Molecular Weight | 446.426 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI1679 |