ETALOCIB

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C33H33FO6
Molecular Weight	544.6099
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETALOCIB

Structure Search

SMILES

CCCC1=C(OC2=C(C=CC=C2)C(O)=O)C=CC=C1OCCCOC3=C(CC)C=C(C(O)=C3)C4=CC=C(F)C=C4

InChI

InChIKey=YFIZRWPXUYFCSN-UHFFFAOYSA-N

InChI=1S/C33H33FO6/c1-3-9-25-29(12-7-13-30(25)40-31-11-6-5-10-26(31)33(36)37)38-18-8-19-39-32-21-28(35)27(20-22(32)4-2)23-14-16-24(34)17-15-23/h5-7,10-17,20-21,35H,3-4,8-9,18-19H2,1-2H3,(H,36,37)

HIDE SMILES / InChI

Molecular Formula	C33H33FO6
Molecular Weight	544.6099
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:03:57 UTC 2023` Edited by `admin` on `Fri Dec 15 16:03:57 UTC 2023`
Record UNII	THY6RIW44R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETALOCIB

Official Name

English

2-(3-(3-((5-ETHYL-4'-FLUORO-2-HYDROXYBIPHENYL-4-YL)OXY)PROPOXY)-2-PROPYLPHENOXY)BENZOIC ACID

Systematic Name

English

BENZOIC ACID, 2-(3-(3-((5-ETHYL-4'-FLUORO-2-HYDROXY(1,1'-BIPHENYL)-4-YL)OXY)PROPOXY)-2-PROPYLPHENOXY)-

Common Name

English

etalocib [INN]

Common Name

English

Etalocib [WHO-DD]

Common Name

English

LY-293111

Code

English

LY-193111

Code

English

LY293111

Code

English

ETALOCIB [USAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C308

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

Code System Code Type Description

INN

8360

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

USAN

NN-64

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

ChEMBL

CHEMBL329123

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

FDA UNII

THY6RIW44R

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

EPA CompTox

DTXSID70167073

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

NCI_THESAURUS

C1626

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

DRUG BANK

DB12850

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

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SMS_ID

100000179986

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

CAS

161172-51-6

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

PUBCHEM

177941

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

WIKIPEDIA

ETALOCIB

Created by admin on Fri Dec 15 16:03:57 UTC 2023 , Edited by admin on Fri Dec 15 16:03:57 UTC 2023

PRIMARY

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ACTIVE MOIETY

Amount: