CEFETECOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H17N5O9S2.4H2O
Molecular Weight	607.568
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H][C@]12SCC=C(N1C(=O)[C@H]2NC(=O)C(=N/O[C@H](C(O)=O)C3=CC(O)=C(O)C=C3)\C4=CSC(N)=N4)C(O)=O

InChI

InChIKey=HYKRFONDLKBUTH-XKULUCSCSA-N

InChI=1S/C20H17N5O9S2.4H2O/c21-20-22-8(6-36-20)12(24-34-14(19(32)33)7-1-2-10(26)11(27)5-7)15(28)23-13-16(29)25-9(18(30)31)3-4-35-17(13)25;;;;/h1-3,5-6,13-14,17,26-27H,4H2,(H2,21,22)(H,23,28)(H,30,31)(H,32,33);4*1H2/b24-12-;;;;/t13-,14+,17-;;;;/m1..../s1

HIDE SMILES / InChI

Molecular Formula	C20H17N5O9S2
Molecular Weight	535.507
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	1
Optical Activity	UNSPECIFIED

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

Description
Sources: https://worldwide.espacenet.com/publicationDetails/biblio?DB=EPODOC&II=0&ND=3&adjacent=true&locale=en_EP&FT=D&date=19880331&CC=DE&NR=3732457A1&KC=A1

Cefetecol is a broad-spectrum cephemcarboxylate derivative with antibacterial activity patented by British pharmaceutical company Glaxo Group Ltd.

Originator

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:28:56 GMT 2023` Edited by `admin` on `Fri Dec 15 16:28:56 GMT 2023`
Record UNII	ST0WR0R5X1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CEFETECOL

Official Name

English

CEFETECOL [USAN]

Common Name

English

GR-69153X

Code

English

GR 69153X

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C357