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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H23ClN2O8
Molecular Weight 478.88
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Epichlortetracycline

SMILES

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

InChI

InChIKey=CYDMQBQPVICBEU-XRZQSNOTSA-N
InChI=1S/C22H23ClN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26,28-29,32-33H,6H2,1-3H3,(H2,24,31)/t7-,8-,15+,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H23ClN2O8
Molecular Weight 478.88
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 21:25:41 GMT 2025
Edited
by admin
on Mon Mar 31 21:25:41 GMT 2025
Record UNII
35ZT5OEQ74
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, (4R,4aS,5aS,6S,12aS)-
Preferred Name English
4-Epichlortetracycline
Common Name English
Quatrimycin, chloro-
Common Name English
CHLORTETRACYCLINE HYDROCHLORIDE IMPURITY A [EP IMPURITY]
Common Name English
4-epi-Chlortetracycline
Common Name English
2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, [4R-(4?,4a?,5a?,6?,12a?)]-
Common Name English
Epichlortetracycline
Common Name English
2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, 4-epimer
Common Name English
Code System Code Type Description
PUBCHEM
54678407
Created by admin on Mon Mar 31 21:25:41 GMT 2025 , Edited by admin on Mon Mar 31 21:25:41 GMT 2025
PRIMARY
EPA CompTox
DTXSID60873792
Created by admin on Mon Mar 31 21:25:41 GMT 2025 , Edited by admin on Mon Mar 31 21:25:41 GMT 2025
PRIMARY
CAS
14297-93-9
Created by admin on Mon Mar 31 21:25:41 GMT 2025 , Edited by admin on Mon Mar 31 21:25:41 GMT 2025
PRIMARY
FDA UNII
35ZT5OEQ74
Created by admin on Mon Mar 31 21:25:41 GMT 2025 , Edited by admin on Mon Mar 31 21:25:41 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
PARENT -> IMPURITY