| SpectraBase Spectrum ID |
8fgi8Kn3Dmp |
| Name |
3-[(1R,12Br)-1-ethyl-4-keto-2,3,6,7,12,12B-hexahydropyrido[2,1-A]$B-carbolin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]propionamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
482.268176349 u |
| Formula |
C30H34N4O2 |
| InChI |
InChI=1S/C30H34N4O2/c1-2-30(15-11-26(35)31-17-13-20-19-32-24-9-5-3-7-21(20)24)16-12-27(36)34-18-14-23-22-8-4-6-10-25(22)33-28(23)29(30)34/h3-10,19,29,32-33H,2,11-18H2,1H3,(H,31,35)/t29-,30+/m0/s1 |
| InChIKey |
FBMYCCPNTWRVBS-XZWHSSHBSA-N |
| Molecular Weight |
482.628 g/mol |
| SMILES |
C12=C(C=3C=CC=CC3N2)CCN2[C@@]1([C@@](CCC2=O)(CCC(=O)NCCC1=CNC2=C1C=CC=C2)CC)[H] |
![3-[(1R,12bR)-1-ethyl-4-keto-2,3,6,7,12,12b-hexahydropyrido[2,1-a]$b-carbolin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]propionamide](/api/spectrum/8fgi8Kn3Dmp/structure.png?h=300&w=458 "3-[(1R,12bR)-1-ethyl-4-keto-2,3,6,7,12,12b-hexahydropyrido[2,1-a]$b-carbolin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]propionamide")
