Type: | Other |
PubChem: | 10000220 |
DrugBank: | None |
IUPAC: | acetic acid [(2S,3S)-5-(2-aminoethyl)-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] ester |
Standard InChI: | InChI=1S/C20H22N2O4S/c1-13(23)26-18-19(14-7-9-15(25-2)10-8-14)27-17-6-4-3-5-16(17)22(12-11-21)20(18)24/h3-10,18-19H,11-12,21H2,1-2H3/t18-,19+/m1/s1 |
Standard InChIKey: | ITPLTCJNLBCHHJ-MOPGFXCFSA-N |
SMILES: | COC1=CC=C(C2SC3=CC=CC=C3N(CCN)C(=O)C2OC(C)=O)C=C1 |
Metabolism-related information: | No data |
Reference: | No data |
Chemical Structure | Metablite's name | Reaction name | Genus | Species | Reference |
---|---|---|---|---|---|
Desacetyl N,N-Didesmethyldiltiazem | Deacylation | Gut microbiota | Gut microbiota | 10.1038/s41586-019-1291-3 |