Acutifolin palmitate

AlkaPlorer ID: AK005368

Synonym: None

IUPAC Name: [(2S)-1-(4,8-dimethoxy-1-methyl-2-oxoquinolin-3-yl)-3-methylbut-3-en-2-yl] hexadecanoate

Structure

SMILES: C=C(C)[C@H](CC1=C(OC)C2=CC=CC(OC)=C2N(C)C1=O)OC(=O)CCCCCCCCCCCCCCC

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InChI: InChI=1S/C33H51NO5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-23-30(35)39-29(25(2)3)24-27-32(38-6)26-21-20-22-28(37-5)31(26)34(4)33(27)36/h20-22,29H,2,7-19,23-24H2,1,3-6H3/t29-/m0/s1

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InChIKey: PIQGWMHSWPDBQZ-LJAQVGFWSA-N

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Source

Properties Information

Molecule Weight: 541.7730000000005

TPSA: 66.75999999999999

MolLogP: 8.06740000000001

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information