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Concept information

Preferred term

هیدروکلراید ent-diltiazem  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C22H27ClN2O4S

inchi

  • InChI=1S/C22H26N2O4S.ClH/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3;/h5-12,20-21H,13-14H2,1-4H3;1H/t20-,21+;/m0./s1

inchikey

  • HDRXZJPWHTXQRI-JUDYQFGCSA-N

mass

  • 450.97900

monoisotopicmass

  • 450.13801

smiles

  • Cl.COc1ccc(cc1)[C@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@H]1OC(C)=O

subset

  • 3_STAR

synonym EXACT

  • (2R,3R)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate hydrochloride

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:82817

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