Deacylisariotin; 7-Me ether, N-(2E-dodecenoyl) 

AlkaPlorer ID: AK294536

Synonym: Antibiotic TK 57-164A, TK 57-164A

IUPAC Name: (E)-N-(1,7-dihydroxy-5-methoxy-10-oxo-3-oxatricyclo[4.3.1.02,4]decan-8-yl)dodec-2-enamide

Structure

SMILES: CCCCCCCCC/C=C/C(=O)NC1CC2(O)C(=O)C(C1O)C(OC)C1OC12

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InChI: InChI=1S/C22H35NO6/c1-3-4-5-6-7-8-9-10-11-12-15(24)23-14-13-22(27)20(26)16(17(14)25)18(28-2)19-21(22)29-19/h11-12,14,16-19,21,25,27H,3-10,13H2,1-2H3,(H,23,24)/b12-11+

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InChIKey: SGVOKQVCWJVGRH-VAWYXSNFSA-N

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Reference

CAS: 745050-50-4

Properties Information

Molecule Weight: 409.52300000000014

TPSA: 108.39

MolLogP: 1.6450999999999996

Number of H-Donors: 3

Number of H-Acceptors: 6

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information