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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H16O2
Molecular Weight 252.3077
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NYASOL

SMILES

OC1=CC=C(\C=C/[C@@H](C=C)C2=CC=C(O)C=C2)C=C1

InChI

InChIKey=VEAUNWQYYMXIRB-JHAQOBCDSA-N
InChI=1S/C17H16O2/c1-2-14(15-7-11-17(19)12-8-15)6-3-13-4-9-16(18)10-5-13/h2-12,14,18-19H,1H2/b6-3-/t14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H16O2
Molecular Weight 252.3077
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
0.85 µM [IC50]

PubMed

Substance Class Chemical
Record UNII
LK6CH9D7UR
Record Status Validated (UNII)
Record Version