| SpectraBase Compound ID | 9UdnQrI96cq |
|---|---|
| InChI | InChI=1S/C26H41ClO10/c1-12(2)18-19-20(26(33,11-27)23(35-14(4)29)21(18)34-13(3)28)16-10-24(6,32)17(31)8-9-25(7,22(19)36-16)37-15(5)30/h12,16-23,31-33H,8-11H2,1-7H3/t16-,17+,18-,19-,20-,21+,22-,23+,24+,25-,26-/m1/s1 |
| InChIKey | NXDBLMKPWYADDE-XVDRNVAYSA-N |
| Mol Weight | 549.1 g/mol |
| Molecular Formula | C26H41ClO10 |
| Exact Mass | 548.238825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GAj1Ebcj8ij |
|---|---|
| Name | KLYMOLLIN_J |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H41ClO10 |
| InChI | InChI=1S/C26H41ClO10/c1-12(2)18-19-20(26(33,11-27)23(35-14(4)29)21(18)34-13(3)28)16-10-24(6,32)17(31)8-9-25(7,22(19)36-16)37-15(5)30/h12,16-23,31-33H,8-11H2,1-7H3/t16-,17+,18-,19-,20-,21+,22-,23+,24+,25-,26-/m1/s1 |
| InChIKey | NXDBLMKPWYADDE-XVDRNVAYSA-N |
| Literature Reference Author | M.C.LIN,B.W.CHEN,C.Y.HUANG,C.F.DAI,T.L.HWANG,J.H.SHEU |
| Literature Reference Citation | J.NAT.PROD.,76,1661(2013) |
| Literature Reference DOI | 10.1021/np400372v |
| Molecular Weight | 549.059 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ43154 |