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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H22N2O8
Molecular Weight 442.4187
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANHYDROOXYTETRACYCLINE

SMILES

[H][C@@]12[C@@H](O)C3=C(C)C4=CC=CC(O)=C4C(O)=C3C(=O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@H]2N(C)C

InChI

InChIKey=GYHZYHMZEAWQFQ-XCLVFQIOSA-N
InChI=1S/C22H22N2O8/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/h4-6,14-15,17,25-28,32H,1-3H3,(H2,23,31)/t14-,15+,17+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H22N2O8
Molecular Weight 442.4187
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:46:24 GMT 2023
Edited
by admin
on Sat Dec 16 09:46:24 GMT 2023
Record UNII
NZ8VEY2EFW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANHYDROOXYTETRACYCLINE
Common Name English
2-NAPHTHACENECARBOXAMIDE, 4-(DIMETHYLAMINO)-1,4,4A,5,12,12A-HEXAHYDRO-3,5,10,11,12A-PENTAHYDROXY-6-METHYL-1,12-DIOXO-, (4S,4AR,5R,12AS)-
Systematic Name English
DEHYDROTETRACYCLINE
Common Name English
(4S,4AR,5R,12AS)-4-(DIMETHYLAMINO)-3,5,10,11,12A-PENTAHYDROXY-6-METHYL-1,12-DIOXO-1,4,4A,5,12,12A-HEXAHYDROTETRACENE-2-CARBOXAMIDE
Systematic Name English
ANHYDRO-OXYTETRACYCLINE
Common Name English
OXYTETRACYCLINE HYDROCHLORIDE IMPURITY F [EP IMPURITY]
Common Name English
DEHYDROCHLORTETRACYCLINE
Common Name English
OXYTETRACYCLINE, ANHYDRO-
Common Name English
Code System Code Type Description
CAS
4660-26-8
Created by admin on Sat Dec 16 09:46:24 GMT 2023 , Edited by admin on Sat Dec 16 09:46:24 GMT 2023
PRIMARY
FDA UNII
NZ8VEY2EFW
Created by admin on Sat Dec 16 09:46:24 GMT 2023 , Edited by admin on Sat Dec 16 09:46:24 GMT 2023
PRIMARY
PUBCHEM
72941459
Created by admin on Sat Dec 16 09:46:24 GMT 2023 , Edited by admin on Sat Dec 16 09:46:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID601314331
Created by admin on Sat Dec 16 09:46:24 GMT 2023 , Edited by admin on Sat Dec 16 09:46:24 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
total of impurities D, E and F (eluting between the latter two): not more than the area of the peak due to impurity E in the chromatogram obtained with reference solution (g) (2.0 per cent)
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP