VELNACRINE MALEATE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C13H14N2O.C4H4O4
Molecular Weight	330.3352
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of VELNACRINE MALEATE

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.NC1=C2C=CC=CC2=NC3=C1C(O)CCC3

InChI

InChIKey=NEEKVKZFYBQFGT-BTJKTKAUSA-N

InChI=1S/C13H14N2O.C4H4O4/c14-13-8-4-1-2-5-9(8)15-10-6-3-7-11(16)12(10)13;5-3(6)1-2-4(7)8/h1-2,4-5,11,16H,3,6-7H2,(H2,14,15);1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C13H14N2O
Molecular Weight	214.2631
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:38:14 UTC 2023` Edited by `admin` on `Fri Dec 15 15:38:14 UTC 2023`
Record UNII	YY1JW04JCB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VELNACRINE MALEATE

Official Name

English

VELNACRINE MALEATE [MART.]

Common Name

English

P-83-6029A

Code

English

P83 6029A

Code

English

HP-029

Code

English

VELNACRINE MALEATE [USAN]

Common Name

English

VELNACRINE MALEATE [MI]

Common Name

English

Velnacrine maleate [WHO-DD]

Common Name

English

P-836029A

Code

English

(±)-9-AMINO-1,2,3,4-TETRAHYDRO-1-ACRIDINOL MALEATE (1:1) (SALT).

Common Name

English

MENTANE

Brand Name

English

1-ACRIDINOL, 9-AMINO-1,2,3,4-TETRAHYDRO-, (±)-, (Z)-2-BUTENEDIOATE (1:1) (SALT)

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C47792

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

Code System Code Type Description

CAS

118909-22-1

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

MERCK INDEX

m983

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

Merck Index

FDA UNII

YY1JW04JCB

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

EPA CompTox

DTXSID7045158

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

NCI_THESAURUS

C96774

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

PUBCHEM

5702293

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

CAS

121445-18-9

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

SUPERSEDED

ChEMBL

CHEMBL51934

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

USAN

AA-64

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

CAS

112964-99-5

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

SUPERSEDED

CAS

157789-17-8

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

SUPERSEDED

SMS_ID

100000076690

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

EVMPD

SUB15690MIG

Created by admin on Fri Dec 15 15:38:14 UTC 2023 , Edited by admin on Fri Dec 15 15:38:14 UTC 2023

PRIMARY

Related Record Type Details


					Y2P6NV151K

PARENT -> SALT/SOLVATE


					4401EF6U24

VELNACRINE MALEATE, (-)-

ENANTIOMER -> RACEMATE


					WR9885GALS

VELNACRINE MALEATE, (+)-

ENANTIOMER -> RACEMATE

Related Record Type Details


					Y2P6NV151K

ACTIVE MOIETY