N-DESMETHYLSPECTINOMYCIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H22N2O7
Molecular Weight	318.323
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12O[C@H](C)CC(=O)[C@]1(O)O[C@]3([H])[C@@H](N)[C@@H](O)[C@@H](NC)[C@H](O)[C@@]3([H])O2

InChI

InChIKey=VXHQYMNLSNTSIM-IPMIWKELSA-N

InChI=1S/C13H22N2O7/c1-4-3-5(16)13(19)12(20-4)21-11-9(18)7(15-2)8(17)6(14)10(11)22-13/h4,6-12,15,17-19H,3,14H2,1-2H3/t4-,6+,7-,8-,9+,10-,11-,12+,13+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C13H22N2O7
Molecular Weight	318.323
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:56:09 UTC 2023` Edited by `admin` on `Sat Dec 16 18:56:09 UTC 2023`
Record UNII	7EQ4RS89N2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-DESMETHYLSPECTINOMYCIN

Common Name

English

(2R,4AR,5AR,6S,7R,8R,9S,9AR,10AS)-6-AMINO-4A,7,9-TRIHYDROXY-2-METHYL-8-(METHYLAMINO)DECAHYDRO-4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE

Systematic Name

English

4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE, 6-AMINODECAHYDRO-4A,7,9-TRIHYDROXY-2-METHYL-8-(METHYLAMINO)-, (2R-(2.ALPHA.,4A.BETA.,5A.BETA.,6.BETA.,7.BETA.,8.BETA.,9.ALPHA.,9A.ALPHA.,10A.BETA.))-

Common Name

English

SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE IMPURITY E [EP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

7EQ4RS89N2

Created by admin on Sat Dec 16 18:56:10 UTC 2023 , Edited by admin on Sat Dec 16 18:56:10 UTC 2023

PRIMARY

CAS

88270-91-1

Created by admin on Sat Dec 16 18:56:10 UTC 2023 , Edited by admin on Sat Dec 16 18:56:10 UTC 2023

PRIMARY

PUBCHEM

25001799

Created by admin on Sat Dec 16 18:56:10 UTC 2023 , Edited by admin on Sat Dec 16 18:56:10 UTC 2023

PRIMARY

Related Record Type Details


					HWT06H303Z

SPECTINOMYCIN HYDROCHLORIDE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: