DORIPENEM, (.BETA.-LACTAM RING OPENED)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H26N4O7S2
Molecular Weight	438.52
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DORIPENEM, (.BETA.-LACTAM RING OPENED)-

Structure Search

SMILES

[H][C@]([C@@H](C)O)(C(O)=O)[C@]1([H])NC(C(O)=O)=C(S[C@@H]2CN[C@H](CNS(N)(=O)=O)C2)[C@@H]1C

InChI

InChIKey=DGCDKVKIMXIBKA-VFZPANTDSA-N

InChI=1S/C15H26N4O7S2/c1-6-11(10(7(2)20)14(21)22)19-12(15(23)24)13(6)27-9-3-8(17-5-9)4-18-28(16,25)26/h6-11,17-20H,3-5H2,1-2H3,(H,21,22)(H,23,24)(H2,16,25,26)/t6-,7-,8+,9+,10-,11-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H26N4O7S2
Molecular Weight	438.52
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:44:30 UTC 2023` Edited by `admin` on `Sat Dec 16 09:44:30 UTC 2023`
Record UNII	2RGM29ZCR8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DORIPENEM, (.BETA.-LACTAM RING OPENED)-

Common Name

English

DORIPENEM-M1

Common Name

English

1H-PYRROLE-2-ACETIC ACID, 4-(((3S,5S)-5-(((AMINOSULFONYL)AMINO)METHYL)-3-PYRROLIDINYL)THIO)-5-CARBOXY-2,3-DIHYDRO-.ALPHA.-((1R)-1-HYDROXYETHYL)-3-METHYL-, (.ALPHA.S,2S,3R)-

Systematic Name

English

Code System Code Type Description

FDA UNII

2RGM29ZCR8

Created by admin on Sat Dec 16 09:44:30 UTC 2023 , Edited by admin on Sat Dec 16 09:44:30 UTC 2023

PRIMARY

PUBCHEM

44472890

Created by admin on Sat Dec 16 09:44:30 UTC 2023 , Edited by admin on Sat Dec 16 09:44:30 UTC 2023

PRIMARY

CAS

1222629-57-3

Created by admin on Sat Dec 16 09:44:30 UTC 2023 , Edited by admin on Sat Dec 16 09:44:30 UTC 2023

PRIMARY

Related Record Type Details


					BHV525JOBH

DORIPENEM

PARENT -> METABOLITE INACTIVE

Comments:

primarily via dehydropeptidase-I

Interaction Type:

MAJOR

Qualification:

PLASMA; URINE

Amount: