(-)-neopestalotin E

AlkaPlorer ID: AK072740

Synonym: None

IUPAC Name: [(E)-3-methyl-5-oxo-5-[[(2R)-2,4,5-trimethyl-3-oxofuran-2-yl]amino]pent-3-enyl] acetate

Structure

SMILES: CC(=O)OCC/C(C)=C/C(O)=N[C@]1(C)OC(C)=C(C)C1=O

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InChI: InChI=1S/C15H21NO5/c1-9(6-7-20-12(4)17)8-13(18)16-15(5)14(19)10(2)11(3)21-15/h8H,6-7H2,1-5H3,(H,16,18)/b9-8+/t15-/m1/s1

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InChIKey: LNXFKXGYRFJRIN-XVJNWHFHSA-N

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Source

Properties Information

Molecule Weight: 295.33500000000004

TPSA: 85.19

MolLogP: 2.4518000000000004

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information