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Details

Stereochemistry ACHIRAL
Molecular Formula C19H15NO8
Molecular Weight 385.3243
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALIZARIN COMPLEXONE

SMILES

OC(=O)CN(CC(O)=O)CC1=C(O)C(O)=C2C(=O)C3=CC=CC=C3C(=O)C2=C1

InChI

InChIKey=PWIGYBONXWGOQE-UHFFFAOYSA-N
InChI=1S/C19H15NO8/c21-13(22)7-20(8-14(23)24)6-9-5-12-15(19(28)16(9)25)18(27)11-4-2-1-3-10(11)17(12)26/h1-5,25,28H,6-8H2,(H,21,22)(H,23,24)

HIDE SMILES / InChI

Molecular Formula C19H15NO8
Molecular Weight 385.3243
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
TX8W05MTS6
Record Status Validated (UNII)
Record Version