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Details

Stereochemistry ACHIRAL
Molecular Formula C13H10O5
Molecular Weight 246.2155
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KHELLOL

SMILES

COC1=C2C(=O)C=C(CO)OC2=CC3=C1C=CO3

InChI

InChIKey=QBZKHNHPZMJJJI-UHFFFAOYSA-N
InChI=1S/C13H10O5/c1-16-13-8-2-3-17-10(8)5-11-12(13)9(15)4-7(6-14)18-11/h2-5,14H,6H2,1H3

HIDE SMILES / InChI

Molecular Formula C13H10O5
Molecular Weight 246.2155
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
QO1J4DA0RG
Record Status Validated (UNII)
Record Version