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Concept information

Preferred term

هیدروکلراید هیدروکلراید Iptacopan  

Type

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

Broader concept

charge

  • 0

formula

  • C25H30N2O4.H2O.ClH

has_role

inchi

  • InChI=1S/C25H30N2O4.ClH.H2O/c1-4-31-19-10-12-27(22(14-19)17-5-7-18(8-6-17)25(28)29)15-21-20-9-11-26-24(20)16(2)13-23(21)30-3;;/h5-9,11,13,19,22,26H,4,10,12,14-15H2,1-3H3,(H,28,29);1H;1H2/t19-,22-;;/m0../s1

inchikey

  • JUWBBUFSAGEROP-VVJLZRNGSA-N

mass

  • 477.000

monoisotopicmass

  • 476.20780

smiles

  • O.Cl.[H][C@]1(C[C@H](CCN1CC1=C(OC)C=C(C)C2=C1C=CN2)OCC)C1=CC=C(C=C1)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 4-{(2S,4S)-4-ethoxy-1-[(5-methoxy-7-methyl-1H-indol-4-yl)methyl]piperidin-2-yl}benzoic acid hydrochloride hydrate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:229654

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