4-EPIDOXYCYCLINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H24N2O8
Molecular Weight	444.4346
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12[C@@H](C)C3=CC=CC(O)=C3C(=O)C1=C(O)[C@]4(O)C(=O)C(C(N)=O)=C(O)[C@H](N(C)C)[C@]4([H])[C@H]2O

InChI

InChIKey=JBIWCJUYHHGXTC-NLJUDYQYSA-N

InChI=1S/C22H24N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29/h4-7,10,14-15,17,25,27-29,32H,1-3H3,(H2,23,31)/t7-,10+,14+,15+,17-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H24N2O8
Molecular Weight	444.4346
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:27:24 UTC 2023` Edited by `admin` on `Sat Dec 16 05:27:24 UTC 2023`
Record UNII	TR57F2W7Q6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-EPIDOXYCYCLINE

Common Name

English

DOXYCYCLINE MONOHYDRATE IMPURITY C [EP IMPURITY]

Common Name

English

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

Common Name

English

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

Common Name

English

DOXYCYCLINE HYCLATE IMPURITY C [EP IMPURITY]

Common Name

English

4-EPIOXYTETRACYCLINE, 6-DEOXY-

Common Name

English

(4R,4AR,5S,5AR,6R,12AS)-4-(DIMETHYLAMINO)-3,5,10,12,12APENTAHYDROXY-6-METHYL-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-CARBOXAMIDE

Common Name

English

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

Common Name

English

DOXYCYCLINE IMPURITY C

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID901316643

Created by admin on Sat Dec 16 05:27:25 UTC 2023 , Edited by admin on Sat Dec 16 05:27:25 UTC 2023

PRIMARY

CAS

6543-77-7

Created by admin on Sat Dec 16 05:27:25 UTC 2023 , Edited by admin on Sat Dec 16 05:27:25 UTC 2023

PRIMARY

FDA UNII

TR57F2W7Q6

Created by admin on Sat Dec 16 05:27:25 UTC 2023 , Edited by admin on Sat Dec 16 05:27:25 UTC 2023

PRIMARY

Related Record Type Details


					N12000U13O

DOXYCYCLINE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					19XTS3T51U

DOXYCYCLINE HYCLATE

PARENT -> IMPURITY