DU-6681

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H19N3O4S
Molecular Weight	349.405
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(S[C@@H]3CN4C=CN=C4C3)=C(N2C1=O)C(O)=O

InChI

InChIKey=SYFIHQJVKJGGGB-SXLYUPOASA-N

InChI=1S/C16H19N3O4S/c1-7-12-11(8(2)20)15(21)19(12)13(16(22)23)14(7)24-9-5-10-17-3-4-18(10)6-9/h3-4,7-9,11-12,20H,5-6H2,1-2H3,(H,22,23)/t7-,8-,9+,11-,12-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H19N3O4S
Molecular Weight	349.405
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Approval Year

Substance Class	Chemical
Record UNII	VL8A7ME6X8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DU-6681

Common Name

English

DU6681

Preferred Name

English

1-AZABICYCLO(3.2.0)HEPT-2-ENE-2-CARBOXYLIC ACID, 3-(((6S)-6,7-DIHYDRO-5H-PYRROLO(1,2-A)IMIDAZOL-6-YL)THIO)-6-((1R)-1-HYDROXYETHYL)-4-METHYL-7-OXO-, (4R,5S,6S)-

Systematic Name

English

1-AZABICYCLO(3.2.0)HEPT-2-ENE-2-CARBOXYLIC ACID, 3-((6,7-DIHYDRO-5H-PYRROLO(1,2-A)IMIDAZOL-6-YL)THIO)-6-(1-HYDROXYETHYL)-4-METHYL-7-OXO-, (4R-(3(S*),4.ALPHA.,5.BETA.,6.BETA.(R*)))-

Common Name

English

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Code System

Code

Type

Description

FDA UNII

VL8A7ME6X8

PRIMARY

EPA CompTox

DTXSID501338049

PRIMARY

PUBCHEM

9819755

PRIMARY

MANUFACTURER PRODUCT INFORMATION

DU 6681

PRIMARY

CAS

129951-17-3

PRIMARY

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Related Record

Type

Details


					FN8NM9XR4K

DZ-2640

PRODRUG -> METABOLITE ACTIVE

Comments:

DZ-2640 is the ester-type oral carbapenem prodrug of an active parent compound, DU-6681. The pharmacokinetics and safety of DU-6681 were investigated in six studies after oral administration of a single dose of DZ-2640 to healthy male Japanese volunteers at doses of 25, 50, 100, 200, and 400 mg (as the equivalents of DU-6681) in the fasted state.

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