1-[(1R,3R)-2-(7-methoxy-2H-1,3-benzodioxol-5-yl)-3-(2-oxo-5,6-dihydropyridine-1-carbonyl)-4-(3,4,5-trimethoxyphenyl)cyclobutanecarbonyl]-5,6-dihydropyridin-2-one

AlkaPlorer ID: AK019291

Synonym: None

IUPAC Name: 1-[(1R,3R)-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-(6-oxo-2,3-dihydropyridine-1-carbonyl)-4-(3,4,5-trimethoxyphenyl)cyclobutanecarbonyl]-2,3-dihydropyridin-6-one

Structure

SMILES: COC1=CC([C@H]2[C@@H](C(=O)N3CCC=CC3=O)[C@H](C3=CC(OC)=C4OCOC4=C3)[C@@H]2C(=O)N2CCC=CC2=O)=CC(OC)=C1OC

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InChI: InChI=1S/C33H34N2O10/c1-40-20-13-18(14-21(41-2)30(20)43-4)26-28(32(38)34-11-7-5-9-24(34)36)27(29(26)33(39)35-12-8-6-10-25(35)37)19-15-22(42-3)31-23(16-19)44-17-45-31/h5-6,9-10,13-16,26-29H,7-8,11-12,17H2,1-4H3/t26-,27-,28-,29-/m1/s1

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InChIKey: RANXPERGLCULGS-CXDXLJMYSA-N

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Properties Information

Molecule Weight: 618.6390000000002

TPSA: 130.14

MolLogP: 3.1933000000000016

Number of H-Donors: 0

Number of H-Acceptors: 10

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information