Preferred Name

raloxifene hydrochloride

Synonyms

[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothien-3-yl][4-(2-piperidin-1-ylethoxy)phenyl]methanone hydrochloride

6-Hydroxy-2-(p-hydroxyphenyl)benzo(b)thien-3-yl-p-(2-piperidinoethoxy)phenyl ketone, hydrochloride

Evista

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

Definitions

A hydrochloride salt resulting from the reaction of equimolar amounts of raloxifene and hydrogen chloride.

ID

http://purl.obolibrary.org/obo/CHEBI_50740

charge

0

database_cross_reference

PMID:22888234

Reaxys:6036780

PMID:22889955

KEGG:D02217

PMID:23293211

PMID:24228255

CAS:82640-04-8

PMID:10098223

PMID:25246789

PMID:21562721

PMID:25037077

Beilstein:6036780

PMID:25348734

PMID:11006795

DrugBank:DB00481

PMID:11951945

definition

A hydrochloride salt resulting from the reaction of equimolar amounts of raloxifene and hydrogen chloride.

formula

C28H28ClNO4S

C28H27NO4S.HCl

has part

http://purl.obolibrary.org/obo/CHEBI_90191

has role

http://purl.obolibrary.org/obo/CHEBI_50739

http://purl.obolibrary.org/obo/CHEBI_50646

http://purl.obolibrary.org/obo/CHEBI_50837

has_exact_synonym

[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothien-3-yl][4-(2-piperidin-1-ylethoxy)phenyl]methanone hydrochloride

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

has_obo_namespace

chebi_ontology

has_related_synonym

6-Hydroxy-2-(p-hydroxyphenyl)benzo(b)thien-3-yl-p-(2-piperidinoethoxy)phenyl ketone, hydrochloride

Evista

id

CHEBI:50740

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C28H27NO4S.ClH/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;1H

inchikey

BKXVVCILCIUCLG-UHFFFAOYSA-N

label

raloxifene hydrochloride

mass

510.046

monoisotopicmass

509.14276

notation

CHEBI:50740

prefLabel

raloxifene hydrochloride

smiles

S1C(=C(C2=C1C=C(O)C=C2)C(=O)C3=CC=C(OCCN4CCCCC4)C=C3)C5=CC=C(O)C=C5.Cl

treeView

http://purl.obolibrary.org/obo/CHEBI_36807

subClassOf

http://purl.obolibrary.org/obo/CHEBI_36807

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