| SpectraBase Spectrum ID |
9cdEjfQ0ZoN |
| Name |
Stebisimine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H34N2O6 |
| InChI |
InChI=1S/C36H34N2O6/c1-39-29-10-7-22-16-27-26-20-32(30(40-2)18-23(26)11-13-37-27)44-36-34-24(19-33(41-3)35(36)42-4)12-14-38-28(34)15-21-5-8-25(9-6-21)43-31(29)17-22/h5-10,17-20H,11-16H2,1-4H3 |
| InChIKey |
PPHBQUYBKOCYSQ-UHFFFAOYSA-N |
| Molecular Weight |
590.676 g/mol |
| SMILES |
c12c3C(=NCCc3cc(c1OC)OC)Cc1ccc(Oc3cc(CC=4c5cc(O2)c(cc5CCN4)OC)ccc3OC)cc1 |
| SPLASH |
splash10-0006-0000090000-4aea6accc7c2f3d6d48d |
| Source of Spectrum |
X2-45-500-3 |
| Wiley ID |
1601016 |
