| SpectraBase Compound ID | FHbFnwOw39A |
|---|---|
| InChI | InChI=1S/C28H35ClO11/c1-11-9-10-18(35-14(4)30)27(8)19(11)23(37-16(6)32)28-13(3)26(34)39-24(28)20(29)12(2)21(40-28)22(36-15(5)31)25(27)38-17(7)33/h13,18-25H,1-2,9-10H2,3-8H3/t13-,18-,19?,20-,21+,22+,23-,24-,25-,27-,28+/m0/s1 |
| InChIKey | PXWWTSQKNXBHTK-IKCYDSDPSA-N |
| Mol Weight | 583.0 g/mol |
| Molecular Formula | C28H35ClO11 |
| Exact Mass | 582.18679 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A9KGu6OuevG |
|---|---|
| Name | JUNCEELLIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H35ClO11 |
| InChI | InChI=1S/C28H35ClO11/c1-11-9-10-18(35-14(4)30)27(8)19(11)23(37-16(6)32)28-13(3)26(34)39-24(28)20(29)12(2)21(40-28)22(36-15(5)31)25(27)38-17(7)33/h13,18-25H,1-2,9-10H2,3-8H3/t13-,18-,19?,20-,21+,22+,23-,24-,25-,27-,28+/m0/s1 |
| InChIKey | PXWWTSQKNXBHTK-IKCYDSDPSA-N |
| Literature Reference Author | C.SUBRAHMANYAM,R.KULATHEESWARAN,R.S.WARD |
| Literature Reference Citation | J.NAT.PROD.,61,1120(1998) |
| Literature Reference DOI | 10.1021/np960576v |
| Molecular Weight | 583.032 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP2155 |