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Details

Stereochemistry ACHIRAL
Molecular Formula C22H25NO2
Molecular Weight 335.4394
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LOBELANINE

SMILES

CN1[C@@H](CC(=O)C2=CC=CC=C2)CCC[C@H]1CC(=O)C3=CC=CC=C3

InChI

InChIKey=IDEMKXUAULKYJV-BGYRXZFFSA-N
InChI=1S/C22H25NO2/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18/h2-7,9-12,19-20H,8,13-16H2,1H3/t19-,20+

HIDE SMILES / InChI

Molecular Formula C22H25NO2
Molecular Weight 335.4394
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
4XWB84090T
Record Status Validated (UNII)
Record Version