ALVAMELINE MALEATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H15N5.C4H4O4
Molecular Weight	309.3211
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ALVAMELINE MALEATE

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.CCN1N=NC(=N1)C2=CCCN(C)C2

InChI

InChIKey=YKFYFAAWVQGVTP-BTJKTKAUSA-N

InChI=1S/C9H15N5.C4H4O4/c1-3-14-11-9(10-12-14)8-5-4-6-13(2)7-8;5-3(6)1-2-4(7)8/h5H,3-4,6-7H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI

Molecular Formula	C9H15N5
Molecular Weight	193.2489
Charge	0
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:42:43 UTC 2023` Edited by `admin` on `Fri Dec 15 15:42:43 UTC 2023`
Record UNII	76732QSQ30
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALVAMELINE MALEATE

Official Name

English

PYRIDINE, 3-(2-ETHYL-2H-TETRAZOL-5-YL)-1,2,5,6-TETRAHYDRO-1-METHYL-, (2Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

LU 25-109-M

Code

English

ALVAMELINE MALEATE [USAN]

Common Name

English

LU-25-109-M

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C47796

Created by admin on Fri Dec 15 15:42:43 UTC 2023 , Edited by admin on Fri Dec 15 15:42:43 UTC 2023

Code System Code Type Description

ChEMBL

CHEMBL131428

Created by admin on Fri Dec 15 15:42:43 UTC 2023 , Edited by admin on Fri Dec 15 15:42:43 UTC 2023

PRIMARY

PUBCHEM

6450824

Created by admin on Fri Dec 15 15:42:43 UTC 2023 , Edited by admin on Fri Dec 15 15:42:43 UTC 2023

PRIMARY

CAS

219581-36-9

Created by admin on Fri Dec 15 15:42:43 UTC 2023 , Edited by admin on Fri Dec 15 15:42:43 UTC 2023

PRIMARY

FDA UNII

76732QSQ30

Created by admin on Fri Dec 15 15:42:43 UTC 2023 , Edited by admin on Fri Dec 15 15:42:43 UTC 2023

PRIMARY

USAN

NN-35

Created by admin on Fri Dec 15 15:42:43 UTC 2023 , Edited by admin on Fri Dec 15 15:42:43 UTC 2023

PRIMARY

NCI_THESAURUS

C76609

Created by admin on Fri Dec 15 15:42:43 UTC 2023 , Edited by admin on Fri Dec 15 15:42:43 UTC 2023

PRIMARY

SMS_ID

300000044455

Created by admin on Fri Dec 15 15:42:43 UTC 2023 , Edited by admin on Fri Dec 15 15:42:43 UTC 2023

PRIMARY

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