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Details

Stereochemistry ACHIRAL
Molecular Formula C21H18NO4
Molecular Weight 348.3719
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of NITIDINE

SMILES

COC1=CC2=C(C=C1OC)C3=C(C4=CC5=C(OCO5)C=C4C=C3)[N+](C)=C2

InChI

InChIKey=KKMPSGJPCCJYRV-UHFFFAOYSA-N
InChI=1S/C21H18NO4/c1-22-10-13-7-17(23-2)18(24-3)8-15(13)14-5-4-12-6-19-20(26-11-25-19)9-16(12)21(14)22/h4-10H,11H2,1-3H3/q+1

HIDE SMILES / InChI

Molecular Formula C21H18NO4
Molecular Weight 348.3719
Charge 1
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

Targets

Primary TargetPharmacologyConditionPotency
1.34 mM [IC50]

PubMed

Substance Class Chemical
Record UNII
933301178Z
Record Status Validated (UNII)
Record Version