dicentrine-β-N-oxide

AlkaPlorer ID: AK011980

Synonym: None

IUPAC Name: None

Structure

SMILES: [H][C@@](C1)([N@+]([O-])(CC2)C)C3=C2C=C(OCO4)C4=C3C(C=C5OC)=C1C=C5OC

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InChI: InChI=1S/C20H21NO5/c1-21(22)5-4-11-7-17-20(26-10-25-17)19-13-9-16(24-3)15(23-2)8-12(13)6-14(21)18(11)19/h7-9,14H,4-6,10H2,1-3H3/t14-,21+/m0/s1

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InChIKey: UTOHNPYVBQCFDL-LHSJRXKWSA-N

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Properties Information

Molecule Weight: 355.39000000000016

TPSA: 59.980000000000004

MolLogP: 3.1972000000000023

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information