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Details

Stereochemistry ACHIRAL
Molecular Formula C17H13O7S.Na
Molecular Weight 384.336
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 3-(1-hydroxy-9,10-dioxoanthracen-2-yl)oxypropane-1-sulfonate

SMILES

[Na+].OC1=C2C(=O)C3=CC=CC=C3C(=O)C2=CC=C1OCCCS([O-])(=O)=O

InChI

InChIKey=MBADHSDWCNJBOJ-UHFFFAOYSA-M
InChI=1S/C17H14O7S.Na/c18-15-10-4-1-2-5-11(10)16(19)14-12(15)6-7-13(17(14)20)24-8-3-9-25(21,22)23;/h1-2,4-7,20H,3,8-9H2,(H,21,22,23);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
Sodium 3-(1-hydroxy-9,10-dioxoanthracen-2-yl)oxypropane-1-sulfonate
Systematic Name English
1-Propanesulfonic acid, 3-[(9,10-dihydro-1-hydroxy-9,10-dioxo-2-anthracenyl)oxy]-, monosodium salt
Preferred Name English
1-Propanesulfonic acid, 3-[(9,10-dihydro-1-hydroxy-9,10-dioxo-2-anthracenyl)oxy]-, sodium salt (1:1)
Common Name English
Code System Code Type Description
CAS
65520-53-8
Created by admin on Wed Apr 02 17:05:48 GMT 2025 , Edited by admin on Wed Apr 02 17:05:48 GMT 2025
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FDA UNII
VPW8AB2G6X
Created by admin on Wed Apr 02 17:05:48 GMT 2025 , Edited by admin on Wed Apr 02 17:05:48 GMT 2025
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EPA CompTox
DTXSID10215820
Created by admin on Wed Apr 02 17:05:48 GMT 2025 , Edited by admin on Wed Apr 02 17:05:48 GMT 2025
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PUBCHEM
23703836
Created by admin on Wed Apr 02 17:05:48 GMT 2025 , Edited by admin on Wed Apr 02 17:05:48 GMT 2025
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