13(a)-Acetoxy-anhydroisoheximide

AlkaPlorer ID: AK000925

Synonym: None

IUPAC Name: [(1R,3E,5R)-3-[2-(2,6-dioxopiperidin-4-yl)ethylidene]-1,5-dimethyl-4-oxocyclohexyl] acetate

Structure

SMILES: CC(=O)O[C@@]1(C)C/C(=C\CC2CC(=O)N=C(O)C2)C(=O)[C@H](C)C1

copy

InChI: InChI=1S/C17H23NO5/c1-10-8-17(3,23-11(2)19)9-13(16(10)22)5-4-12-6-14(20)18-15(21)7-12/h5,10,12H,4,6-9H2,1-3H3,(H,18,20,21)/b13-5+/t10-,17-/m1/s1

copy

InChIKey: OYHDNVYRXVFVIC-WKHVRVIBSA-N

copy

Source

Properties Information

Molecule Weight: 321.37300000000005

TPSA: 93.03

MolLogP: 2.516800000000001

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information