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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H39N5O7.H2O4S
Molecular Weight 547.621
Optical Activity UNSPECIFIED
Defined Stereocenters 12 / 12
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GENTAMICIN C1A SULFATE

SMILES

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

InChI

InChIKey=HNCAOLPMSASREN-UCMBPTNBSA-N
InChI=1S/C19H39N5O7.H2O4S/c1-19(27)7-28-18(13(26)16(19)24-2)31-15-11(23)5-10(22)14(12(15)25)30-17-9(21)4-3-8(6-20)29-17;1-5(2,3)4/h8-18,24-27H,3-7,20-23H2,1-2H3;(H2,1,2,3,4)/t8-,9+,10-,11+,12-,13+,14+,15-,16+,17+,18+,19-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C19H39N5O7
Molecular Weight 449.5423
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 12 / 12
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:35:40 UTC 2023
Edited
by admin
on Fri Dec 15 15:35:40 UTC 2023
Record UNII
S7K05PO157
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GENTAMICIN C1A SULFATE
Common Name English
D-STREPTAMINE, O-3-DEOXY-4-C-METHYL-3-(METHYLAMINO)-.BETA.-L-ARABINOPYRANOSYL-(1->6)-O-(2,6-DIAMINO-2,3,4,6-TETRADEOXY-.ALPHA.-D-ERYTHRO-HEXOPYRANOSYL-(1->4))-2-DEOXY-, SULFATE
Common Name English
Code System Code Type Description
DRUG BANK
DBSALT002339
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID40191148
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
PUBCHEM
21115148
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
FDA UNII
S7K05PO157
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
CAS
37713-04-5
Created by admin on Fri Dec 15 15:35:40 UTC 2023 , Edited by admin on Fri Dec 15 15:35:40 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE