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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H16O7PS.3K
Molecular Weight 500.628
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Tripotassium (1S)-4-(3-phenoxyphenyl)-1-phosphonatobutane-1-sulfonate

SMILES

[K+].[K+].[K+].[O-]P([O-])(=O)[C@H](CCCC1=CC=CC(OC2=CC=CC=C2)=C1)S([O-])(=O)=O

InChI

InChIKey=DRADVLDMPYYQDB-OKUPDQQSSA-K
InChI=1S/C16H19O7PS.3K/c17-24(18,19)16(25(20,21)22)11-5-7-13-6-4-10-15(12-13)23-14-8-2-1-3-9-14;;;/h1-4,6,8-10,12,16H,5,7,11H2,(H2,17,18,19)(H,20,21,22);;;/q;3*+1/p-3/t16-;;;/m0.../s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Tripotassium (1S)-4-(3-phenoxyphenyl)-1-phosphonatobutane-1-sulfonate
Systematic Name English
Benzenebutanesulfonic acid, 3-phenoxy-α-phosphono-, potassium salt (1:3), (αS)-
Systematic Name English
Code System Code Type Description
PUBCHEM
15784674
Created by admin on Sat Dec 16 19:51:02 GMT 2023 , Edited by admin on Sat Dec 16 19:51:02 GMT 2023
PRIMARY
FDA UNII
4D757LZ9MF
Created by admin on Sat Dec 16 19:51:02 GMT 2023 , Edited by admin on Sat Dec 16 19:51:02 GMT 2023
PRIMARY
CAS
157126-15-3
Created by admin on Sat Dec 16 19:51:02 GMT 2023 , Edited by admin on Sat Dec 16 19:51:02 GMT 2023
PRIMARY