3-O-DEMETHYL ASTROMICIN DISULFATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H33N5O6.2H2O4S
Molecular Weight	587.62
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-O-DEMETHYL ASTROMICIN DISULFATE

Structure Search

SMILES

OS(O)(=O)=O.OS(O)(=O)=O.[H][C@]1(CC[C@@H](N)[C@@]([H])(O[C@@H]2[C@@H](N)[C@H](O)[C@H](O)[C@H]([C@H]2O)N(C)C(=O)CN)O1)[C@H](C)N

InChI

InChIKey=HSAJHSLTNYVOPX-NMVGBPJZSA-N

InChI=1S/C16H33N5O6.2H2O4S/c1-6(18)8-4-3-7(19)16(26-8)27-15-10(20)12(23)13(24)11(14(15)25)21(2)9(22)5-17;2*1-5(2,3)4/h6-8,10-16,23-25H,3-5,17-20H2,1-2H3;2*(H2,1,2,3,4)/t6-,7+,8-,10-,11+,12-,13+,14+,15+,16+;;/m0../s1

HIDE SMILES / InChI

Molecular Formula	H2O4S
Molecular Weight	98.078
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C16H33N5O6
Molecular Weight	391.4631
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:23:16 GMT 2023` Edited by `admin` on `Fri Dec 15 15:23:16 GMT 2023`
Record UNII	HZH4HVY7WE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-O-DEMETHYL ASTROMICIN DISULFATE

Common Name

English

3-O-DEMETHYLFORTIMICIN A DISULFATE

Common Name

English

A-49759 DISULFATE

Code

English

L-CHIRO-INOSITOL, 4-AMINO-1-((AMINOACETYL)METHYLAMINO)-1,4-DIDEOXY-3-O-(2,6-DIAMINO-2,3,4,6,7-PENTADEOXY-.BETA.-L-LYXO-HEPTOPYRANOSYL)-, SULFATE (1:2) (SALT)

Systematic Name

English

3-O-DEMETHYL ASTROMICIN DISULPHATE

Common Name

English

Code System Code Type Description

PUBCHEM

133082769

Created by admin on Fri Dec 15 15:23:16 GMT 2023 , Edited by admin on Fri Dec 15 15:23:16 GMT 2023

PRIMARY

CAS

76155-59-4

Created by admin on Fri Dec 15 15:23:16 GMT 2023 , Edited by admin on Fri Dec 15 15:23:16 GMT 2023

NON-SPECIFIC STOICHIOMETRY

FDA UNII

HZH4HVY7WE

Created by admin on Fri Dec 15 15:23:16 GMT 2023 , Edited by admin on Fri Dec 15 15:23:16 GMT 2023

PRIMARY

CAS

86286-54-6

Created by admin on Fri Dec 15 15:23:16 GMT 2023 , Edited by admin on Fri Dec 15 15:23:16 GMT 2023

PRIMARY

Related Record Type Details


					WAO3WE4TPT

3-O-DEMETHYL ASTROMICIN

PARENT -> SALT/SOLVATE