Mycelianamide

AlkaPlorer ID: AK064259

Synonym: None

IUPAC Name: (3E,6S)-3-[[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]phenyl]methylidene]-1,4-dihydroxy-6-methylpiperazine-2,5-dione

Structure

SMILES: CC(C)=CCC/C(C)=C/COC1=CC=C(/C=C2\C(=O)N(O)[C@@H](C)C(=O)N2O)C=C1

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InChI: InChI=1S/C22H28N2O5/c1-15(2)6-5-7-16(3)12-13-29-19-10-8-18(9-11-19)14-20-22(26)23(27)17(4)21(25)24(20)28/h6,8-12,14,17,27-28H,5,7,13H2,1-4H3/b16-12+,20-14+/t17-/m0/s1

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InChIKey: JIGPABZIAJWQNM-MSODBRDKSA-N

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Source

Properties Information

Molecule Weight: 400.4750000000001

TPSA: 90.31

MolLogP: 3.936700000000002

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information