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CHEBI:114318 - 2-[(4-amino-7-tert-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetic acid
| Formula | C16H21N3O2S2 |
| Net Charge | 0 |
| Average Mass | 351.497 |
| Monoisotopic Mass | 351.10752 |
| SMILES | CC(C)(C)C1CCc2c(sc3nc(SCC(=O)O)nc(N)c23)C1 |
| InChI | InChI=1S/C16H21N3O2S2/c1-16(2,3)8-4-5-9-10(6-8)23-14-12(9)13(17)18-15(19-14)22-7-11(20)21/h8H,4-7H2,1-3H3,(H,20,21)(H2,17,18,19) |
| InChIKey | PQDXZFSCGCGOFN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(4-amino-7-tert-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetic acid (CHEBI:114318) is a organic heterobicyclic compound (CHEBI:27171) |
| 2-[(4-amino-7-tert-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetic acid (CHEBI:114318) is a organonitrogen heterocyclic compound (CHEBI:38101) |
| 2-[(4-amino-7-tert-butyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetic acid (CHEBI:114318) is a organosulfur heterocyclic compound (CHEBI:38106) |
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