Rohitukine

AlkaPlorer ID: AK312632

Synonym: None

IUPAC Name: 5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)-2-methylchromen-4-one

Structure

SMILES: CC1=CC(=O)C2=C(O1)C(C1CCN(C)CC1O)=C(O)C=C2O

copy

InChI: InChI=1S/C16H19NO5/c1-8-5-10(18)15-12(20)6-11(19)14(16(15)22-8)9-3-4-17(2)7-13(9)21/h5-6,9,13,19-21H,3-4,7H2,1-2H3

copy

InChIKey: MOCVYVBNJQIVOV-UHFFFAOYSA-N

copy

Properties Information

Molecule Weight: 305.33

TPSA: 94.14

MolLogP: 1.2926199999999997

Number of H-Donors: 3

Number of H-Acceptors: 6

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information