| SpectraBase Compound ID | AJ9nzRxibpK |
|---|---|
| InChI | InChI=1S/C21H28O9/c1-7-10-5-13(28-21-18(26)17(25)16(24)14(6-22)29-21)9(3)15(10)19-11(4-12(7)23)8(2)20(27)30-19/h10-19,21-26H,1-6H2/t10?,11-,12+,13-,14+,15?,16+,17-,18+,19-,21+/m0/s1 |
| InChIKey | ARJUJAMZTUUZNZ-PBIQXZOHSA-N |
| Mol Weight | 424.45 g/mol |
| Molecular Formula | C21H28O9 |
| Exact Mass | 424.173332 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CEPNQqV5Jk0 |
|---|---|
| Name | MACROCLINISIDE A |
| Compound Number | 401 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C21H28O9/c1-7-10-5-13(28-21-18(26)17(25)16(24)14(6-22)29-21)9(3)15(10)19-11(4-12(7)23)8(2)20(27)30-19/h10-19,21-26H,1-6H2/t10?,11-,12+,13-,14+,15?,16+,17-,18+,19-,21+/m0/s1 |
| InChIKey | ARJUJAMZTUUZNZ-PBIQXZOHSA-N |
| Literature Reference | A.UR-RAHMAN,V.U.AHMAD NAT.PROD.VOL.1 |
| Solvent | Pyridine-d5 |