Molecule

3-hydroxy-2-[(3S,4S)-3-(2-methoxyphenyl)-4-phenyl-3,4-dihydropyridazin-6-yl]inden-1-one

AlkaPlorer ID: AK123578

Synonym: None

IUPAC Name: 3-hydroxy-2-[(3S,4S)-3-(2-methoxyphenyl)-4-phenyl-3,4-dihydropyridazin-6-yl]inden-1-one

Structure

SMILES: COC1=CC=CC=C1[C@H]1N=NC(C2=C(O)C3=CC=CC=C3C2=O)=C[C@H]1C1=CC=CC=C1

InChI: InChI=1S/C26H20N2O3/c1-31-22-14-8-7-13-19(22)24-20(16-9-3-2-4-10-16)15-21(27-28-24)23-25(29)17-11-5-6-12-18(17)26(23)30/h2-15,20,24,29H,1H3/t20-,24+/m0/s1

InChIKey: QQLADQBGQNDNSN-GBXCKJPGSA-N

Reference

Alkaloids of Schelhammera pedunculata (Liliaceae). III. The structures of schelhammericine and alkaloids A, B, E, G, H, J, and K

PubChem CID: 163160066

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain

Properties Information

Molecule Weight: 408.4570000000001

TPSA？: 71.25

MolLogP？: 6.035400000000005

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi