ISOCHLORTETRACYCLINE, (1R)-

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 ISOCHLORTETRACYCLINE, (1R)-

Structure Search

SMILES

CN(C)[C@H]1[C@@H]2C[C@@H](CC(=O)[C@]2(O)C(=O)C(C(N)=O)=C1O)[C@@]3(C)OC(=O)C4=C3C(Cl)=CC=C4O

InChI

InChIKey=GFSLIMZISCAANG-CUJCIORFSA-N

InChI=1S/C22H23ClN2O8/c1-21(15-10(23)4-5-11(26)13(15)20(31)33-21)8-6-9-16(25(2)3)17(28)14(19(24)30)18(29)22(9,32)12(27)7-8/h4-5,8-9,16,26,28,32H,6-7H2,1-3H3,(H2,24,30)/t8-,9-,16-,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 21:32:33 GMT 2025` Edited by `admin` on `Mon Mar 31 21:32:33 GMT 2025`
Record UNII	D60759UL8R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOCHLORTETRACYCLINE, (1R)-

Common Name

English

2-NAPHTHALENECARBOXAMIDE, 6-((1R)-7-CHLORO-1,3-DIHYDRO-4-HYDROXY-1-METHYL-3-OXO-1-ISOBENZOFURANYL)-4-(DIMETHYLAMINO)-1,4,4A,5,6,7,8,8A-OCTAHYDRO-3,8A-DIHYDROXY-1,8-DIOXO-, (4S,4AS,6S,8AS)-

Preferred Name

English

6-((1R)-7-CHLORO-4-HYDROXY-1-METHYL-3-OXO-1,3-DIHYDRO-2-BENZOFURAN-1-YL)-4-(DIMETHYLAMINO)-3,8A-DIHYDROXY-1,8-DIOXO-1,4,4A,5,6,7,8,8A-OCTAHYDRONAPHTHALENE-2-CARBOXAMIDE, (4S,4AS,6S,8AS)-

Common Name

English

2-NAPHTHALENECARBOXAMIDE, 6-(7-CHLORO-1,3-DIHYDRO-4-HYDROXY-1-METHYL-3-OXO-1-ISOBENZOFURANYL)-4-(DIMETHYLAMINO)-1,4,4A,5,6,7,8,8A-OCTAHYDRO-3,8A-DIHYDROXY-1,8-DIOXO-, (4S-(4.ALPHA.,4A.ALPHA.,6.BETA.(S*),8A.ALPHA.))-

Common Name

English

CHLORTETRACYCLINE HYDROCHLORIDE IMPURITY G [EP IMPURITY]

Common Name

English

Code System Code Type Description

CAS

769895-23-0

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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EPA CompTox

DTXSID601098715

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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FDA UNII

D60759UL8R

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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PUBCHEM

71587798

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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