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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H17O9.K
Molecular Weight 440.4419
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of POTASSIUM DANTHRON GLUCOSIDE

SMILES

[K+].OC[C@H]1O[C@@H](OC2=C3C(=O)C4=C(C=CC=C4[O-])C(=O)C3=CC=C2)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=PCUPBZRSKVXLQJ-NULLJREZSA-M
InChI=1S/C20H18O9.K/c21-7-12-16(24)18(26)19(27)20(29-12)28-11-6-2-4-9-14(11)17(25)13-8(15(9)23)3-1-5-10(13)22;/h1-6,12,16,18-22,24,26-27H,7H2;/q;+1/p-1/t12-,16-,18+,19-,20-;/m1./s1

HIDE SMILES / InChI

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H17O9
Molecular Weight 401.3436
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 17:35:13 GMT 2025
Edited
by admin
on Mon Mar 31 17:35:13 GMT 2025
Record UNII
B73V221XZH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DANTHRON GLUCOSIDE POTASSIUM SALT
Preferred Name English
POTASSIUM DANTHRON GLUCOSIDE
Common Name English
9,10-ANTHRACENEDIONE, 1-(.BETA.-D-GLUCOPYRANOSYLOXY)-8-HYDROXY-, POTASSIUM SALT
Systematic Name English
Code System Code Type Description
PUBCHEM
122201384
Created by admin on Mon Mar 31 17:35:13 GMT 2025 , Edited by admin on Mon Mar 31 17:35:13 GMT 2025
PRIMARY
FDA UNII
B73V221XZH
Created by admin on Mon Mar 31 17:35:13 GMT 2025 , Edited by admin on Mon Mar 31 17:35:13 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE