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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > ammonium ion derivative > raloxifene(1+)
... > chemical entity > molecular entity > ion > cation > polyatomic cation > ammonium ion derivative > raloxifene(1+)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic cation > ammonium ion derivative > raloxifene(1+)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic cation > ammonium ion derivative > raloxifene(1+)

Preferred term

raloxifene(1+)  

Type

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

Broader concept

charge

  • +1

formula

  • C28H28NO4S

inchi

  • InChI=1S/C28H27NO4S/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2/p+1

inchikey

  • GZUITABIAKMVPG-UHFFFAOYSA-O

is_conjugate_acid_of

mass

  • 474.593

monoisotopicmass

  • 474.17336

smiles

  • S1C(=C(C2=C1C=C(O)C=C2)C(=O)C3=CC=C(OCC[NH+]4CCCCC4)C=C3)C5=CC=C(O)C=C5

subset

  • 3_STAR

synonym EXACT

  • 1-[2-(4-{[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]carbonyl}phenoxy)ethyl]piperidinium

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:90191

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