| SpectraBase Compound ID | BmlWqCI8x63 |
|---|---|
| InChI | InChI=1S/C35H34N2O5/c1-37-11-9-22-17-32(40-3)34-35-33(22)27(37)15-20-4-6-28(38)24(12-20)25-13-19(5-7-29(25)39-2)14-26-23-18-31(42-35)30(41-34)16-21(23)8-10-36-26/h4-7,12-13,16-18,26-27,36,38H,8-11,14-15H2,1-3H3/t26-,27-/m0/s1 |
| InChIKey | JIBZGMQXMSPJJE-SVBPBHIXSA-N |
| Mol Weight | 562.7 g/mol |
| Molecular Formula | C35H34N2O5 |
| Exact Mass | 562.246772 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4Js2jwSoUNe |
|---|---|
| Name | Tiliarine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H34N2O5 |
| InChI | InChI=1S/C35H34N2O5/c1-37-11-9-22-17-32(40-3)34-35-33(22)27(37)15-20-4-6-28(38)24(12-20)25-13-19(5-7-29(25)39-2)14-26-23-18-31(42-35)30(41-34)16-21(23)8-10-36-26/h4-7,12-13,16-18,26-27,36,38H,8-11,14-15H2,1-3H3/t26-,27-/m0/s1 |
| InChIKey | JIBZGMQXMSPJJE-SVBPBHIXSA-N |
| Molecular Weight | 562.666 g/mol |
| SMILES | N1CCc2cc3Oc4c(cc5CCN([C@@]6(c5c4Oc3cc2[C@@]1(Cc1ccc(c(-c2cc(ccc2O)C6)c1)OC)[H])[H])C)OC |
| SPLASH | splash10-03dr-0009080000-73a3f65f12f3c3512d82 |
| Source of Spectrum | X2-54-647-185 |
| Wiley ID | 1604025 |