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Details

Stereochemistry RACEMIC
Molecular Formula C16H22INO
Molecular Weight 371.2564
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 7-HYDROXY-PIPAT

SMILES

CCCN(C\C=C\I)C1CCC2=C(C1)C=C(O)C=C2

InChI

InChIKey=RTMIJLQPWFKAFE-FPYGCLRLSA-N
InChI=1S/C16H22INO/c1-2-9-18(10-3-8-17)15-6-4-13-5-7-16(19)12-14(13)11-15/h3,5,7-8,12,15,19H,2,4,6,9-11H2,1H3/b8-3+

HIDE SMILES / InChI

Molecular Formula C16H22INO
Molecular Weight 371.2564
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
N7GRI8K5R7
Record Status Validated (UNII)
Record Version