Substrate Report for: 2-oxo-clopidogrel
2-oxo-clopidogrel | Type (5) |
| Other_Name (7) |
| Chemical_Nomenclature | methyl 2-(2-chlorophenyl)-2-(2-oxo-4,6,7,7a-tetrahydrothieno[3,2-c]pyridin-5-yl)acetate |
| Formula | C16H16ClNO3S |
| CAS_number | 1147350-75-1 |
| MW | 337.81 |
| Pick_me_to_call | display_script | 2-oxo-clopidogrel |
| Paper | Jiang_2017_Front.Pharmacol_8_846 |
| Comment | 2-oxo-clopidogrel is the product of hydrolysis of Vicagrel by CES2 and AADAC and is the substrate of hepathic CES1 |
| Gene_locus | human-CES1 |
| CID | 13748464 |
| Family | Carb_B_Chordata |
| InChIKey | JBSAZVIMJUOBNB-UHFFFAOYSA-N |
| | JBSAZVIMJUOBNB-WUJWULDRSA-N |
| CanonicalSMILES | COC(=O)C(C1=CC=CC=C1Cl)N2CCC3C(=CC(=O)S3)C2 |
| InChI | InChI=1S/C16H16ClNO3S/c1-21-16(20)15(11-4-2-3-5-12(11)17)18-7-6-13-10(9-18)8-14(19)22-13/h2-5,8,13,15H,6-7,9H2,1H3 |
| Wikipedia | 2-oxo-clopidogrel |
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