| SpectraBase Spectrum ID |
BVExrFJ6jsq |
| Name |
AKB48 N-(4-hydroxypentyl) metabolite |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H31N3O2 |
| InChI |
InChI=1S/C23H31N3O2/c1-15(27)5-4-8-26-20-7-3-2-6-19(20)21(25-26)22(28)24-23-12-16-9-17(13-23)11-18(10-16)14-23/h2-3,6-7,15-18,27H,4-5,8-14H2,1H3,(H,24,28)/t15?,16-,17+,18-,23- |
| InChIKey |
RTBQZNKCFFBCBJ-WHOQYPDLSA-N |
| Molecular Weight |
381.520 g/mol |
| SMILES |
N(C(c1n[n](CCCC(C)O)c2ccccc12)=O)C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H] |
| SPLASH |
splash10-01pn-5963000000-1b7814e31c051591ec85 |
| Source of Spectrum |
SWG-33-3474-0 |
| Synonyms |
N-((3s,5s,7s)-adamantan-1-yl)-1-(4-hydroxypentyl)-1H-indazole-3-carboxamide
APINACA N-(4-hydroxypentyl) metabolite
N-(adamantan-1-yl)-1-(4-hydroxypentyl)-1H-indazole-3-carboxamide
N-((1s,3s)-adamantan-1-yl)-1-(4-hydroxypentyl)-1H-indazole-3-carboxamide |
| Wiley ID |
1810282 |
