6.BETA.-NALTREXOL HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H25NO4.ClH
Molecular Weight	379.878
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6.BETA.-NALTREXOL HYDROCHLORIDE

Structure Search

SMILES

Cl.[H][C@@]12OC3=C4C(C[C@H]5N(CC6CC6)CC[C@@]14[C@@]5(O)CC[C@H]2O)=CC=C3O

InChI

InChIKey=FSQFFCPJTDFOAN-CDHBEYIESA-N

InChI=1S/C20H25NO4.ClH/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11;/h3-4,11,14-15,18,22-24H,1-2,5-10H2;1H/t14-,15-,18+,19+,20-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C20H25NO4
Molecular Weight	343.4168
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Mu opioid receptor 221 Target ID: CHEMBL233 Sources: https://www.ncbi.nlm.nih.gov/pubmed/15716384	Neutral Antagonist 4

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:38:13 GMT 2023` Edited by `admin` on `Sat Dec 16 11:38:13 GMT 2023`
Record UNII	765G11MG24
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6.BETA.-NALTREXOL HYDROCHLORIDE

Common Name

English

6.BETA.-HYDROXYNALTREXONE HYDROCHLORIDE

Common Name

English

MORPHINAN-3,6,14-TRIOL, 17-(CYCLOPROPYLMETHYL)-4,5-EPOXY-, HYDROCHLORIDE (1:1), (5.ALPHA.,6.BETA.)-

Systematic Name

English

MORPHINAN-3,6,14-TRIOL, 17-(CYCLOPROPYLMETHYL)-4,5-EPOXY-, HYDROCHLORIDE, (5.ALPHA.,6.BETA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

765G11MG24

Created by admin on Sat Dec 16 11:38:13 GMT 2023 , Edited by admin on Sat Dec 16 11:38:13 GMT 2023

PRIMARY

CAS

55488-86-3

Created by admin on Sat Dec 16 11:38:13 GMT 2023 , Edited by admin on Sat Dec 16 11:38:13 GMT 2023

PRIMARY

PUBCHEM

45110000

Created by admin on Sat Dec 16 11:38:13 GMT 2023 , Edited by admin on Sat Dec 16 11:38:13 GMT 2023

PRIMARY

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6.BETA.-NALTREXOL

PARENT -> SALT/SOLVATE