ALEPLASININ

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H27NO3
Molecular Weight	425.5189
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ALEPLASININ

Structure Search

SMILES

CC1=CC=CC(=C1)C2=CC3=C(C=C2)N(CC4=CC=C(C=C4)C(C)(C)C)C=C3C(=O)C(O)=O

InChI

InChIKey=HSXLMAFNWCSZGP-UHFFFAOYSA-N

InChI=1S/C28H27NO3/c1-18-6-5-7-20(14-18)21-10-13-25-23(15-21)24(26(30)27(31)32)17-29(25)16-19-8-11-22(12-9-19)28(2,3)4/h5-15,17H,16H2,1-4H3,(H,31,32)

HIDE SMILES / InChI

Molecular Formula	C28H27NO3
Molecular Weight	425.5189
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 16:06:10 UTC 2023` Edited by `admin` on `Fri Dec 15 16:06:10 UTC 2023`
Record UNII	LL56J87F3X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALEPLASININ

Official Name

English

aleplasinin [INN]

Common Name

English

Aleplasinin [WHO-DD]

Common Name

English

PAZ-417

Code

English

1H-INDOL-3-ACETIC ACID, 1-((4-(1,1-DIMETHYLETHYL)PHENYL)METHYL)-5-(3-METHYLPHENYL)-.ALPHA.-OXO-

Common Name

English

ALEPLASININ [USAN]

Common Name

English

[1-[4-(1,1-Dimethylethyl)benzyl]-5-(3-methylphenyl)-1H-indol-3-yl]oxoacetic acid

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C783

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

Code System Code Type Description

PUBCHEM

10224267

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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ChEMBL

CHEMBL325424

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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USAN

TT-15

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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CAS

481629-87-2

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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NCI_THESAURUS

C76071

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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SMS_ID

300000034037

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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INN

8939

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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DRUG BANK

DB12635

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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EPA CompTox

DTXSID80197447

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

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FDA UNII

LL56J87F3X

Created by admin on Fri Dec 15 16:06:10 UTC 2023 , Edited by admin on Fri Dec 15 16:06:10 UTC 2023

PRIMARY

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