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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H27N3O2
Molecular Weight 329.4366
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AB-PICA

SMILES

CCCCCN1C=C(C(=O)N[C@@H](C(C)C)C(N)=O)C2=C1C=CC=C2

InChI

InChIKey=GOLDNQQANLFVSP-KRWDZBQOSA-N
InChI=1S/C19H27N3O2/c1-4-5-8-11-22-12-15(14-9-6-7-10-16(14)22)19(24)21-17(13(2)3)18(20)23/h6-7,9-10,12-13,17H,4-5,8,11H2,1-3H3,(H2,20,23)(H,21,24)/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H27N3O2
Molecular Weight 329.4366
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
BWQ0BJ2OGX
Record Status Validated (UNII)
Record Version