| SpectraBase Spectrum ID |
KpiluzyOHXv |
| Name |
4-Carboxy-4,5-seco-6-azachlolestan-5,7-dione |
| Alternate Name(s) |
4-{(4R,6aR,7R,9aS,9bS)-7-[(1R)-1,5-dimethylhexyl]-4,6a-dimethyl-1,3-dioxododecahydro-1H-cyclopenta[h]isoquinolin-4-yl}butanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H43NO4 |
| InChI |
InChI=1S/C26H43NO4/c1-16(2)8-6-9-17(3)18-11-12-19-22-20(13-15-25(18,19)4)26(5,14-7-10-21(28)29)24(31)27-23(22)30/h16-20,22H,6-15H2,1-5H3,(H,28,29)(H,27,30,31)/t17-,18-,19+,20?,22+,25-,26-/m1/s1 |
| InChIKey |
MZVVJVFAHPWBCV-IKSCZSKLSA-N |
| Molecular Weight |
433.633 g/mol |
| SMILES |
N1C([C@](CCCC(=O)O)(C2[C@]([C@]3([C@]([C@]([C@@](CCCC(C)C)(C)[H])([H])CC3)(C)CC2)[H])(C1=O)[H])C)=O |
| SPLASH |
splash10-0002-0009000000-f83512abc0b7f1ae3430 |
| Source of Spectrum |
F-52-14067-16 |
| Wiley ID |
799523 |
