| SpectraBase Compound ID | AO0ESOBNVOx |
|---|---|
| InChI | InChI=1S/C38H44N2O8/c1-39-13-12-24-19-35(47-6)36(21-27(24)28(39)15-22-7-9-32(44-3)30(41)16-22)48-38-25(8-10-33(45-4)37(38)43)17-29-26-20-31(42)34(46-5)18-23(26)11-14-40(29)2/h7-10,16,18-21,28-29,41-43H,11-15,17H2,1-6H3/t28-,29-/m0/s1 |
| InChIKey | TVEKCIXYGVSZJV-VMPREFPWSA-N |
| Mol Weight | 656.8 g/mol |
| Molecular Formula | C38H44N2O8 |
| Exact Mass | 656.309766 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9pklvU4r2TS |
|---|---|
| Name | Efatine |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H44N2O8 |
| InChI | InChI=1S/C38H44N2O8/c1-39-13-12-24-19-35(47-6)36(21-27(24)28(39)15-22-7-9-32(44-3)30(41)16-22)48-38-25(8-10-33(45-4)37(38)43)17-29-26-20-31(42)34(46-5)18-23(26)11-14-40(29)2/h7-10,16,18-21,28-29,41-43H,11-15,17H2,1-6H3/t28-,29-/m0/s1 |
| InChIKey | TVEKCIXYGVSZJV-VMPREFPWSA-N |
| Molecular Weight | 656.776 g/mol |
| SMILES | Oc1cc(C[C@]2(c3cc(Oc4c(c(ccc4C[C@]4(c5c(cc(c(c5)O)OC)CCN4C)[H])OC)O)c(cc3CCN2C)OC)[H])ccc1OC |
| SPLASH | splash10-0006-0900000000-d94e11d61ef5c5bcbf09 |
| Source of Spectrum | X2-54-667-296 |
| Wiley ID | 1604054 |