TETRAZOLAST MEGLUMINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H6N8.C7H17NO5.H2O
Molecular Weight	451.4371
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.N1N=NN=C1C2=CC3=CC=CC=C3N4N=NN=C24

InChI

InChIKey=PXORXOKNKGCVHI-BMWGJIJESA-N

InChI=1S/C10H6N8.C7H17NO5.H2O/c1-2-4-8-6(3-1)5-7(9-11-14-15-12-9)10-13-16-17-18(8)10;1-8-2-4(10)6(12)7(13)5(11)3-9;/h1-5H,(H,11,12,14,15);4-13H,2-3H2,1H3;1H2/t;4-,5+,6+,7+;/m.0./s1

HIDE SMILES / InChI

Molecular Formula	C7H17NO5
Molecular Weight	195.2136
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C10H6N8
Molecular Weight	238.2082
Charge	0
Count

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

Molecular Formula	H2O
Molecular Weight	18.0153
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 15:31:37 UTC 2023` Edited by `admin` on `Fri Dec 15 15:31:37 UTC 2023`
Record UNII	2IY97B405I
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TETRAZOLAST MEGLUMINE

Official Name

English

4-(1H-TETRAZOL-5-YL)TETRAZOLO(1,5-A)QUINOLINE COMPOUND WITH 1-DEOXY-1-(METHYLAMINO)-D-GLUCITOL (1:1), MONOHYDRATE

Common Name

English

TETRAZOLAST MEGLUMINE [USAN]

Common Name

English

MDL 26,024G0

Code

English

TETRAZOLO(1,5-A)QUINOLINE, 4-(1H-TETRAZOL-5-YL)-COMPD. WITH 1-DEOXY-1-(METHYLAMINO)-D-GLUCITOL, (1:1), MONOHYDRATE

Common Name

English

MDL-26024G0

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C29712