.BETA.-APO-OXYTETRACYCLINE

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 Search

SMILES

[H][C@@]1(OC(=O)C2=C(O)C3=C(O)C=CC=C3C(C)=C12)[C@]4([H])[C@@H](O)C(=O)C(C(N)=O)=C(O)[C@H]4N(C)C

InChI

InChIKey=DRKMHDAKULCOKQ-VPZFNDQJSA-N

InChI=1S/C22H22N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)20(32-22(12)31)13-15(24(2)3)17(27)14(21(23)30)19(29)18(13)28/h4-6,13,15,18,20,25-28H,1-3H3,(H2,23,30)/t13-,15-,18+,20-/m0/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 09:54:31 UTC 2023` Edited by `admin` on `Sat Dec 16 09:54:31 UTC 2023`
Record UNII	7HSY5812F9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-APO-OXYTETRACYCLINE

Common Name

English

.BETA.-APOOXYTETRACYCLINE

Common Name

English

OXYTETRACYCLINE HYDROCHLORIDE IMPURITY E [EP IMPURITY]

Common Name

English

.BETA.-APO-5-OXYTETRACYCLINE

Common Name

English

(3S,4S,5R)-4-((1R)-4,5-DIHYDROXY-9-METHYL-3-OXO-1,3-DIHYDRONAPHTHO(2,3-C)FURAN-1-YL)-3-(DIMETHYLAMINO)-2,5-DIHYDROXY-6-OXOCYCLOHEX-1-ENECARBOXAMIDE

Systematic Name

English

APOOXYTETRACYCLINE, .BETA.

Common Name

English

1-CYCLOHEXENE-1-CARBOXAMIDE, 4-((1R)-1,3-DIHYDRO-4,5-DIHYDROXY-9-METHYL-3-OXONAPHTHO(2,3-C)FURAN-1-YL)-3-(DIMETHYLAMINO)-2,5-DIHYDROXY-6-OXO-, (3S,4S,5R)-

Systematic Name

English

.BETA.-APOTERRAMYCIN

Common Name

English

Code System Code Type Description

CAS

18751-99-0