| SpectraBase Compound ID | 7z7dWX0nfHs |
|---|---|
| InChI | InChI=1S/C28H39NO18.ClH/c1-10(30)38-9-18-20(39-11(2)31)21(40-12(3)32)19(29)28(46-18)47-27-25(44-16(7)36)23(42-14(5)34)22(41-13(4)33)24(43-15(6)35)26(27)45-17(8)37;/h18-28H,9,29H2,1-8H3;1H/t18-,19-,20-,21-,22-,23-,24+,25-,26-,27-,28-;/m1./s1 |
| InChIKey | WRGNVPICFZFJFC-RTFHRNMTSA-N |
| Mol Weight | 714.1 g/mol |
| Molecular Formula | C28H40ClNO18 |
| Exact Mass | 713.193391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5yF4my2oTB9 |
|---|---|
| Name | WRGNVPICFZFJFC-RTFHRNMTSA-N |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40ClNO18 |
| InChI | InChI=1S/C28H39NO18.ClH/c1-10(30)38-9-18-20(39-11(2)31)21(40-12(3)32)19(29)28(46-18)47-27-25(44-16(7)36)23(42-14(5)34)22(41-13(4)33)24(43-15(6)35)26(27)45-17(8)37;/h18-28H,9,29H2,1-8H3;1H/t18-,19-,20-,21-,22-,23-,24+,25-,26-,27-,28-;/m1./s1 |
| InChIKey | WRGNVPICFZFJFC-RTFHRNMTSA-N |
| Literature Reference Author | S.LEE,J.P.N.ROSAZZA |
| Literature Reference Citation | ORG.LETTERS,6,365(2004) |
| Literature Reference DOI | 10.1021/ol0362008 |
| Molecular Weight | 714.074 g/mol |
| Sample ID | 50226 |
| Solvent | CD3OD |