| SpectraBase Compound ID | EWE8EqoTFSz |
|---|---|
| InChI | InChI=1S/C36H62O7/c1-25(2)14-9-16-27(5)18-11-19-28(6)20-12-22-31(43-35-34(40)33(39)32(38)30(24-37)42-35)36(8,41)23-13-21-29(7)17-10-15-26(3)4/h14-15,18,20-21,30-35,37-41H,9-13,16-17,19,22-24H2,1-8H3/b27-18+,28-20+,29-21+/t30-,31?,32-,33+,34+,35+,36?/m1/s1 |
| InChIKey | AAEDIAWSKYSEKJ-ULWXIDRDSA-N |
| Mol Weight | 606.9 g/mol |
| Molecular Formula | C36H62O7 |
| Exact Mass | 606.449554 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Nzo5vekvTp |
|---|---|
| Name | IRPEXAN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H62O7 |
| InChI | InChI=1S/C36H62O7/c1-25(2)14-9-16-27(5)18-11-19-28(6)20-12-22-31(43-35-34(40)33(39)32(38)30(24-37)42-35)36(8,41)23-13-21-29(7)17-10-15-26(3)4/h14-15,18,20-21,30-35,37-41H,9-13,16-17,19,22-24H2,1-8H3/b27-18+,28-20+,29-21+/t30-,31?,32-,33+,34+,35+,36?/m1/s1 |
| InChIKey | AAEDIAWSKYSEKJ-ULWXIDRDSA-N |
| Literature Reference Author | S.SILBERBORTH,G.ERKEL,T.ANKE,O.STERNER |
| Literature Reference Citation | J.ANTIBIOTICS,53,1137(2000) |
| Literature Reference DOI | 10.7164/antibiotics.53.1137 |
| Molecular Weight | 606.884 g/mol |
| Solvent | CDCl3 |