CEPHRADINE MONOHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H19N3O4S.H2O
Molecular Weight	367.42
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.[H][C@]12SCC(C)=C(N1C(=O)[C@H]2NC(=O)[C@H](N)C3=CCC=CC3)C(O)=O

InChI

InChIKey=VHNPSPMQGXQSET-CYJZLJNKSA-N

InChI=1S/C16H19N3O4S.H2O/c1-8-7-24-15-11(14(21)19(15)12(8)16(22)23)18-13(20)10(17)9-5-3-2-4-6-9;/h2-3,6,10-11,15H,4-5,7,17H2,1H3,(H,18,20)(H,22,23);1H2/t10-,11-,15-;/m1./s1

HIDE SMILES / InChI

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

Molecular Formula	C16H19N3O4S
Molecular Weight	349.405
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 `Fri Dec 15 15:34:57 UTC 2023` Edited by `admin` on `Fri Dec 15 15:34:57 UTC 2023`
Record UNII	FUC0D71IZN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CEPHRADINE MONOHYDRATE

Common Name

English

CEPHRADINE MONOHYDRATE [MI]

Common Name

English

Cefradine monohydrate [WHO-DD]

Common Name

English

(6R,7R)-7-((R)-2-AMINO-2-(1,4-CYCLOHEXADIEN-1-YL)ACETAMIDO)-3-METHYL-8-OXO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID MONOHYDRATE

Systematic Name

English

CEFRADINE MONOHYDRATE

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C357