| SpectraBase Spectrum ID |
8OBfyF0fPtZ |
| Name |
ADBICA N-(5-hydroxypentyl) metabolite |
| Alternate Name(s) |
N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(5-hydroxypentyl)-1H-indole-3-carboxamide
(R)-N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(5-hydroxypentyl)-1H-indole-3-carboxamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H29N3O3 |
| InChI |
InChI=1S/C20H29N3O3/c1-20(2,3)17(18(21)25)22-19(26)15-13-23(11-7-4-8-12-24)16-10-6-5-9-14(15)16/h5-6,9-10,13,17,24H,4,7-8,11-12H2,1-3H3,(H2,21,25)(H,22,26)/t17-/m0/s1 |
| InChIKey |
ICYIIRAAIJKCGW-KRWDZBQOSA-N |
| Molecular Weight |
359.470 g/mol |
| SMILES |
N(C(c1c[n](CCCCCO)c2ccccc12)=O)[C@@](C(N)=O)(C(C)(C)C)[H] |
| SPLASH |
splash10-001i-2590000000-e4428534105f0ad7328a |
| Source of Spectrum |
SWG-33-3549-0 |
| Wiley ID |
1810339 |
