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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H15NO6S
Molecular Weight 325.337
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SALMISTEINE

SMILES

CC(=O)N[C@@H](CSC(=O)C1=CC=CC=C1OC(C)=O)C(O)=O

InChI

InChIKey=QLOBGRBOWVVKIE-NSHDSACASA-N
InChI=1S/C14H15NO6S/c1-8(16)15-11(13(18)19)7-22-14(20)10-5-3-4-6-12(10)21-9(2)17/h3-6,11H,7H2,1-2H3,(H,15,16)(H,18,19)/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H15NO6S
Molecular Weight 325.337
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:20:17 GMT 2023
Edited
by admin
on Fri Dec 15 16:20:17 GMT 2023
Record UNII
VS9ES6R0ON
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SALMISTEINE
INN  
INN  
Official Name English
L-CYSTEINE, N-ACETYL-S-(2-(ACETYLOXY)BENZOYL)-
Systematic Name English
salmisteine [INN]
Common Name English
N-ACETYL-L-CYSTEINE SALICYLATE (ESTER), ACETATE (ESTER)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C257
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
Code System Code Type Description
SMS_ID
100000080547
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
FDA UNII
VS9ES6R0ON
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
CAS
89767-59-9
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
PUBCHEM
9905347
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
INN
6153
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID80237872
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
NCI_THESAURUS
C90911
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
EVMPD
SUB10431MIG
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104494
Created by admin on Fri Dec 15 16:20:17 GMT 2023 , Edited by admin on Fri Dec 15 16:20:17 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY