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Details

Stereochemistry RACEMIC
Molecular Formula C20H14O
Molecular Weight 270.3246
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-HYDROXY-7,8-DIHYDROBENZO(A)PYRENE, (±)-

SMILES

OC1CC=CC2=C3C=CC4=CC=CC5=CC=C(C=C12)C3=C45

InChI

InChIKey=CKLFVNJOVKIITI-UHFFFAOYSA-N
InChI=1S/C20H14O/c21-18-6-2-5-15-16-10-9-13-4-1-3-12-7-8-14(11-17(15)18)20(16)19(12)13/h1-5,7-11,18,21H,6H2

HIDE SMILES / InChI

Molecular Formula C20H14O
Molecular Weight 270.3246
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
8TYR1800QP
Record Status Validated (UNII)
Record Version