4-EPIDEMETHYLCHLORTETRACYCLINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H21ClN2O8
Molecular Weight	464.853
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-EPIDEMETHYLCHLORTETRACYCLINE

Structure Search

SMILES

CN(C)[C@@H]1[C@@H]2C[C@@H]3[C@H](O)C4=C(Cl)C=CC(O)=C4C(=O)C3=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O

InChI

InChIKey=FMTDIUIBLCQGJB-PTACOPLGSA-N

InChI=1S/C21H21ClN2O8/c1-24(2)14-7-5-6-10(16(27)12-9(25)4-3-8(22)11(12)15(6)26)18(29)21(7,32)19(30)13(17(14)28)20(23)31/h3-4,6-7,14-15,25-26,28-29,32H,5H2,1-2H3,(H2,23,31)/t6-,7-,14+,15-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H21ClN2O8
Molecular Weight	464.853
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:32:33 GMT 2025` Edited by `admin` on `Mon Mar 31 21:32:33 GMT 2025`
Record UNII	YF293A4IUH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(4R,4AS,5AS,6S,12AS)-7-CHLORO-4-(DIMETHYLAMINO)-3,6,10,12,12A-PENTAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-CARBOXAMIDE

Preferred Name

English

4-EPIDEMETHYLCHLORTETRACYCLINE

Common Name

English

2-NAPHTHACENECARBOXAMIDE, 7-CHLORO-4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,6,10,12,12A-PENTAHYDROXY-1,11-DIOXO-, (4R-(4.ALPHA.,4A.BETA.,5A.BETA.,6.ALPHA.,12A.BETA.))-

Common Name

English

CHLORTETRACYCLINE HYDROCHLORIDE IMPURITY E [EP IMPURITY]

Common Name

English

4-EPI-DEMECLOCYCLINE

Common Name

English

2-NAPHTHACENECARBOXAMIDE, 7-CHLORO-4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,6,10,12,12A-PENTAHYDROXY-1,11-DIOXO-, (4R,4AS,5AS,6S,12AS)-

Common Name

English

2-NAPHTHACENECARBOXAMIDE, 7-CHLORO-4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,6,10,12,12A-PENTAHYDROXY-1,11-DIOXO-, 4-EPIMER

Common Name

English

4-EPIDEMECLOCYCLINE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID201315701

Created by admin on Mon Mar 31 21:32:33 GMT 2025 , Edited by admin on Mon Mar 31 21:32:33 GMT 2025

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CAS

14206-59-8

Created by admin on Mon Mar 31 21:32:33 GMT 2025 , Edited by admin on Mon Mar 31 21:32:33 GMT 2025

PRIMARY

FDA UNII

YF293A4IUH

Created by admin on Mon Mar 31 21:32:33 GMT 2025 , Edited by admin on Mon Mar 31 21:32:33 GMT 2025

PRIMARY

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