.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-AMINO-1-(3,4-DIMETHYLPHENYL)-3-METHYL-1H-PYRAZOL-5-YL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H23N3O7
Molecular Weight	393.3911
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-AMINO-1-(3,4-DIMETHYLPHENYL)-3-METHYL-1H-PYRAZOL-5-YL

Structure Search

SMILES

CC1=NN(C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)=C1N)C3=CC=C(C)C(C)=C3

InChI

InChIKey=PCQHGLOJFPSSEK-GLRLOKQVSA-N

InChI=1S/C18H23N3O7/c1-7-4-5-10(6-8(7)2)21-16(11(19)9(3)20-21)28-18-14(24)12(22)13(23)15(27-18)17(25)26/h4-6,12-15,18,22-24H,19H2,1-3H3,(H,25,26)/t12-,13-,14+,15-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H23N3O7
Molecular Weight	393.3911
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:52:53 GMT 2023` Edited by `admin` on `Sat Dec 16 14:52:53 GMT 2023`
Record UNII	JH69S2D5D4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-AMINO-1-(3,4-DIMETHYLPHENYL)-3-METHYL-1H-PYRAZOL-5-YL

Systematic Name

English

ELTROMBOPAG METABOLITE M4

Common Name

English

4-AMINO-1-(3,4-DIMETHYLPHENYL)-3-METHYL-1H-PYRAZOL-5-YL .BETA.-D-GLUCOPYRANOSIDURONIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

JH69S2D5D4

Created by admin on Sat Dec 16 14:52:53 GMT 2023 , Edited by admin on Sat Dec 16 14:52:53 GMT 2023

PRIMARY

PUBCHEM

156028038

Created by admin on Sat Dec 16 14:52:53 GMT 2023 , Edited by admin on Sat Dec 16 14:52:53 GMT 2023

PRIMARY

CAS

1395101-34-4

Created by admin on Sat Dec 16 14:52:53 GMT 2023 , Edited by admin on Sat Dec 16 14:52:53 GMT 2023

PRIMARY

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					S56D65XJ9G

ELTROMBOPAG

PARENT -> METABOLITE

Qualification:

URINE

Amount: