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Details

Stereochemistry ACHIRAL
Molecular Formula C10H4N2O8S.2K
Molecular Weight 390.409
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIPOTASSIUM FLAVIANATE

SMILES

[K+].[K+].[O-]C1=C(C=C(C2=CC=C(C=C12)S([O-])(=O)=O)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=JEAVZHPHDNESJD-UHFFFAOYSA-L
InChI=1S/C10H6N2O8S.2K/c13-10-7-3-5(21(18,19)20)1-2-6(7)8(11(14)15)4-9(10)12(16)17;;/h1-4,13H,(H,18,19,20);;/q;2*+1/p-2

HIDE SMILES / InChI

Molecular Formula C10H4N2O8S
Molecular Weight 312.212
Charge -2
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
13IK41N39A
Record Status Validated (UNII)
Record Version