ZELAVESPIB

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H21IN6O2S
Molecular Weight	512.368
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ZELAVESPIB

Structure Search

SMILES

CC(C)NCCCN1C(SC2=C(I)C=C3OCOC3=C2)=NC4=C(N)N=CN=C14

InChI

InChIKey=SUPVGFZUWFMATN-UHFFFAOYSA-N

InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23)

HIDE SMILES / InChI

Molecular Formula	C18H21IN6O2S
Molecular Weight	512.368
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 19:44:25 UTC 2023` Edited by `admin` on `Fri Dec 15 19:44:25 UTC 2023`
Record UNII	06IVK87M04
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ZELAVESPIB

Official Name

English

PUH-71

Code

English

PU-H71

Code

English

zelavespib [INN]

Common Name

English

PU-H-71

Code

English

9H-PURINE-9-PROPANAMINE, 6-AMINO-8-((6-IODO-1,3-BENZODIOXOL-5-YL)THIO)-N-(1-METHYLETHYL)-

Systematic Name

English

PU-H 71

Code

English

Classification Tree Code System Code

FDA ORPHAN DRUG

638018

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

Code System Code Type Description

EVMPD

SUB195349

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

FDA UNII

06IVK87M04

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

SMS_ID

100000181586

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

CAS

873436-91-0

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

INN

11448

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

EPA CompTox

DTXSID20236288

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

DRUG BANK

DB12638

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

MESH

C526550

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

NCI_THESAURUS

C101227

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

PUBCHEM

9549213

Created by admin on Fri Dec 15 19:44:25 UTC 2023 , Edited by admin on Fri Dec 15 19:44:25 UTC 2023

PRIMARY

Related Record Type Details


					0NB0Z0L5G3

ZELAVESPIB MONOHYDRATE

SOLVATE->ANHYDROUS


					ZEO4G69K8S

ZELAVESPIB DIHYDROCHLORIDE

SALT/SOLVATE -> PARENT

Amount:


					AV0IRM9HF5

ZELAVESPIB TRIHYDROCHLORIDE

SALT/SOLVATE -> PARENT

Amount:


					GDA794T1VC

HEAT SHOCK PROTEIN 90KD ALPHA

TARGET -> INHIBITOR

Amount:


					35RT31667F

ZELAVESPIB I-124

LABELED -> NON-LABELED

Amount:


					0NB0Z0L5G3

ZELAVESPIB MONOHYDRATE

SALT/SOLVATE -> PARENT

Amount:


					WHT95Y619Y

ZELAVESPIB MONOHYDROCHLORIDE

SALT/SOLVATE -> PARENT

Amount:

Related Record Type Details


					06IVK87M04

ACTIVE MOIETY

Amount: