| SpectraBase Compound ID | 1FFhQKjb3zO |
|---|---|
| InChI | InChI=1S/C37H40N2O6/c1-38-12-10-23-18-32(43-4)33-20-25(23)28(38)16-21-6-8-30(40)26(14-21)27-15-22(7-9-31(27)42-3)17-29-35-24(11-13-39(29)2)19-34(44-5)36(41)37(35)45-33/h6-9,14-15,18-20,28-29,40-41H,10-13,16-17H2,1-5H3/t28-,29+/m1/s1 |
| InChIKey | MNNXIEANPHEHSB-WDYNHAJCSA-N |
| Mol Weight | 608.7 g/mol |
| Molecular Formula | C37H40N2O6 |
| Exact Mass | 608.288637 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JnEE0jQVC4P |
|---|---|
| Name | Antioquine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C37H40N2O6 |
| InChI | InChI=1S/C37H40N2O6/c1-38-12-10-23-18-32(43-4)33-20-25(23)28(38)16-21-6-8-30(40)26(14-21)27-15-22(7-9-31(27)42-3)17-29-35-24(11-13-39(29)2)19-34(44-5)36(41)37(35)45-33/h6-9,14-15,18-20,28-29,40-41H,10-13,16-17H2,1-5H3/t28-,29+/m1/s1 |
| InChIKey | MNNXIEANPHEHSB-WDYNHAJCSA-N |
| Molecular Weight | 608.735 g/mol |
| SMILES | Oc1c2c3[C@](Cc4cc(-c5c(ccc(C[C@@]6(c7cc(O2)c(cc7CCN6C)OC)[H])c5)O)c(cc4)OC)(N(CCc3cc1OC)C)[H] |
| SPLASH | splash10-0a4l-0405009000-54ec36577ae5204aa09d |
| Source of Spectrum | X2-50-540-225 |
| Wiley ID | 1602253 |