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Details

Stereochemistry ACHIRAL
Molecular Formula C10H6N2O8S
Molecular Weight 314.228
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FLAVIANIC ACID

SMILES

OC1=C(C=C(C2=CC=C(C=C12)S(O)(=O)=O)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=FCQJEPASRCXVCB-UHFFFAOYSA-N
InChI=1S/C10H6N2O8S/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)

HIDE SMILES / InChI

Molecular Formula C10H6N2O8S
Molecular Weight 314.228
Charge 0
Count
MOL RATIO 1 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
4I7KXL5KL5
Record Status Validated (UNII)
Record Version