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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H23NO4
Molecular Weight 317.3795
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KESSELRINGINE

SMILES

[H][C@@]12CC[C@]34CC[C@@H](O)[C@@](C3)(OC)OC5=C4C1=C(CCN2)C=C5O

InChI

InChIKey=LEFDMAOTHOSJAA-MBUVNVKMSA-N
InChI=1S/C18H23NO4/c1-22-18-9-17(6-3-13(18)21)5-2-11-14-10(4-7-19-11)8-12(20)16(23-18)15(14)17/h8,11,13,19-21H,2-7,9H2,1H3/t11-,13-,17+,18+/m1/s1

HIDE SMILES / InChI

Approval Year