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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H43N5O7.H2O4S
Molecular Weight 575.674
Optical Activity UNSPECIFIED
Defined Stereocenters 13 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GENTAMICIN C1 SULFATE

SMILES

OS(O)(=O)=O.[H][C@]1(CC[C@@H](N)[C@@]([H])(O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@@]3([H])OC[C@](C)(O)[C@H](NC)[C@H]3O)[C@H]2O)O1)[C@@H](C)NC

InChI

InChIKey=NWQISSNHRDDWRM-FDJABWOBSA-N
InChI=1S/C21H43N5O7.H2O4S/c1-9(25-3)13-6-5-10(22)19(31-13)32-16-11(23)7-12(24)17(14(16)27)33-20-15(28)18(26-4)21(2,29)8-30-20;1-5(2,3)4/h9-20,25-29H,5-8,22-24H2,1-4H3;(H2,1,2,3,4)/t9-,10-,11+,12-,13+,14+,15-,16-,17+,18-,19-,20-,21+;/m1./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 C21H43N5O7
Molecular Weight 477.5954
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 13 / 13
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:55:26 UTC 2023
Edited
by admin
on Fri Dec 15 15:55:26 UTC 2023
Record UNII
WLI0S741IL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GENTAMICIN C1 SULFATE
Common Name English
GENTAMICIN C1, SULFATE
Common Name English
Code System Code Type Description
FDA UNII
WLI0S741IL
Created by admin on Fri Dec 15 15:55:26 UTC 2023 , Edited by admin on Fri Dec 15 15:55:26 UTC 2023
PRIMARY
EPA CompTox
DTXSID00191866
Created by admin on Fri Dec 15 15:55:26 UTC 2023 , Edited by admin on Fri Dec 15 15:55:26 UTC 2023
PRIMARY
PUBCHEM
44563965
Created by admin on Fri Dec 15 15:55:26 UTC 2023 , Edited by admin on Fri Dec 15 15:55:26 UTC 2023
PRIMARY
CAS
38539-12-7
Created by admin on Fri Dec 15 15:55:26 UTC 2023 , Edited by admin on Fri Dec 15 15:55:26 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE