| SpectraBase Spectrum ID |
DU8YTA0nRkT |
| Name |
ADBICA N-(4-hydroxypentyl) metabolite |
| Alternate Name(s) |
N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(4-hydroxypentyl)-1H-indole-3-carboxamide
N-((R)-1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(4-hydroxypentyl)-1H-indole-3-carboxamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H29N3O3 |
| InChI |
InChI=1S/C20H29N3O3/c1-13(24)8-7-11-23-12-15(14-9-5-6-10-16(14)23)19(26)22-17(18(21)25)20(2,3)4/h5-6,9-10,12-13,17,24H,7-8,11H2,1-4H3,(H2,21,25)(H,22,26)/t13?,17-/m0/s1 |
| InChIKey |
IZMLODTWDCPVEI-RUINGEJQSA-N |
| Molecular Weight |
359.470 g/mol |
| SMILES |
N(C(c1c[n](CCCC(C)O)c2ccccc12)=O)[C@@](C(N)=O)(C(C)(C)C)[H] |
| SPLASH |
splash10-001i-2690000000-922873aa955f3058034c |
| Source of Spectrum |
SWG-33-3550-0 |
| Wiley ID |
1810340 |
