BENZYLPENILLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H18N2O4S
Molecular Weight	334.39
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1(C)S[C@@H]2[C@H](N=C(CC3=CC=CC=C3)N2[C@H]1C(O)=O)C(O)=O

InChI

InChIKey=PSPRNQOVLYLHSA-RWMBFGLXSA-N

InChI=1S/C16H18N2O4S/c1-16(2)12(15(21)22)18-10(8-9-6-4-3-5-7-9)17-11(14(19)20)13(18)23-16/h3-7,11-13H,8H2,1-2H3,(H,19,20)(H,21,22)/t11-,12-,13+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H18N2O4S
Molecular Weight	334.39
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 22:24:16 GMT 2025` Edited by `admin` on `Tue Apr 01 22:24:16 GMT 2025`
Record UNII	3Z3J540R9X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-76064

Preferred Name

English

BENZYLPENILLIC ACID

Common Name

English

BENZYLPENICILLIN (BENZATHINE) TETRAHYDRATE IMPURITY D [EP IMPURITY]

Common Name

English

BENZYLPENICILLIN SODIUM IMPURITY D [EP IMPURITY]

Common Name

English

2,3,7,7A-TETRAHYDRO-2,2-DIMETHYL-5-(PHENYLMETHYL)IMIDAZO(5,1-B)THIAZOLE-3,7-DICARBOXYLIC ACID

Systematic Name

English

IMIDAZO(5,1-B)THIAZOLE-3,7-DICARBOXYLIC ACID, 5-BENZYL-2,3,7,7A-TETRAHYDRO-2,2-DIMETHYL-

Systematic Name

English

PROCAINE BENZYLPENICILLIN IMPURITY D [EP IMPURITY]

Common Name

English

Penillic acid of benzylpenicillin

Common Name

English

IMIDAZO(5,1-B)THIAZOLE-3,7-DICARBOXYLIC ACID, 2,3,7,7A-TETRAHYDRO-2,2-DIMETHYL-5-(PHENYLMETHYL)-

Systematic Name

English

BENZYLPENICILLIN POTASSIUM IMPURITY D [EP IMPURITY]

Common Name

English

(3S,7R,7AR)-5-BENZYL-2,2-DIMETHYL-2,3,7,7A-TETRAHYDROIMIDAZO(5,1-B)THIAZOLE-3,7-DICARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

3Z3J540R9X