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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H25N3O7
Molecular Weight 443.4498
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N7-DEMETHYLMINOCYCLINE

SMILES

[H][C@@]12CC3=C(NC)C=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])C2

InChI

InChIKey=QIFALPZRQOUILR-ADMKQJKVSA-N
InChI=1S/C22H25N3O7/c1-24-11-4-5-12(26)14-9(11)6-8-7-10-16(25(2)3)18(28)15(21(23)31)20(30)22(10,32)19(29)13(8)17(14)27/h4-5,8,10,16,24,26,28-29,32H,6-7H2,1-3H3,(H2,23,31)/t8-,10-,16-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H25N3O7
Molecular Weight 443.4498
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 01:16:27 UTC 2023
Edited
by admin
on Thu Jul 06 01:16:27 UTC 2023
Record UNII
Y2Y7SRK3P0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N7-DEMETHYLMINOCYCLINE
Common Name English
7-MONODEMETHYLMINOCYCLINE
Common Name English
4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,10,12,12A-TETRAHYDROXY-7-(METHYLAMINO)-1,11-DIOXO-2-NAPHTHACENECARBOXAMIDE
Systematic Name English
MINOCYCLINE HYDROCHLORIDE DIHYDRATE IMPURITY C [EP IMPURITY]
Common Name English
2-NAPHTHACENECARBOXAMIDE, 4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,10,12,12A-TETRAHYDROXY-7-(METHYLAMINO)-1,11-DIOXO-
Common Name English
7-METHYLAMINO-6-DEOXY-6-DEMETHYLTETRACYCLINE
Common Name English
Code System Code Type Description
FDA UNII
Y2Y7SRK3P0
Created by admin on Thu Jul 06 01:16:27 UTC 2023 , Edited by admin on Thu Jul 06 01:16:27 UTC 2023
PRIMARY
CAS
4708-96-7
Created by admin on Thu Jul 06 01:16:27 UTC 2023 , Edited by admin on Thu Jul 06 01:16:27 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
URINE
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP