U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H21ClN2O7
Molecular Weight 460.864
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-EPIANHYDROCHLORTETRACYCLINE

SMILES

[H][C@@]12CC3=C(C(=O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H]2N(C)C)C(O)=C4C(O)=CC=C(Cl)C4=C3C

InChI

InChIKey=NICZYMKKWKYGHT-VIBFLENHSA-N
InChI=1S/C22H21ClN2O7/c1-7-8-6-9-16(25(2)3)18(28)15(21(24)31)20(30)22(9,32)19(29)13(8)17(27)14-11(26)5-4-10(23)12(7)14/h4-5,9,16,26-28,32H,6H2,1-3H3,(H2,24,31)/t9-,16+,22-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
4-EPIANHYDROCHLORTETRACYCLINE
Common Name English
(4R,4AS,12AS)-7-CHLORO-4-(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-6-METHYL-1,11-DIOXO-1,4,4A,5,11,12A-HEXAHYDROTETRACENE-2-CARBOXAMIDE
Common Name English
EPIANHYDROCHLORTETRACYCLINE
Common Name English
2-NAPHTHACENECARBOXAMIDE, 7-CHLORO-4-(DIMETHYLAMINO)-1,4,4A,5,12,12A-HEXAHYDRO-3,10,11,12A-TETRAHYDROXY-6-METHYL-1,12-DIOXO-, (4R-(4.ALPHA.,4A.BETA.,12A.BETA.))-
Common Name English
4-EPI-ANHYDROCHLORTETRACYCLINE
Common Name English
2-NAPHTHACENECARBOXAMIDE, 7-CHLORO-4-(DIMETHYLAMINO)-1,4,4A,5,12,12A-HEXAHYDRO-3,10,11,12A-TETRAHYDROXY-6-METHYL-1,12-DIOXO-, (4R,4AS,12AS)-
Common Name English
CHLORTETRACYCLINE HYDROCHLORIDE IMPURITY K [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
54693279
Created by admin on Sat Dec 16 05:43:11 GMT 2023 , Edited by admin on Sat Dec 16 05:43:11 GMT 2023
PRIMARY
FDA UNII
35ALT456Y9
Created by admin on Sat Dec 16 05:43:11 GMT 2023 , Edited by admin on Sat Dec 16 05:43:11 GMT 2023
PRIMARY
CAS
81163-11-3
Created by admin on Sat Dec 16 05:43:11 GMT 2023 , Edited by admin on Sat Dec 16 05:43:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID901016172
Created by admin on Sat Dec 16 05:43:11 GMT 2023 , Edited by admin on Sat Dec 16 05:43:11 GMT 2023
PRIMARY