Compound ID | 1098

L-681,217

Class: Efrotomycin

Spectrum of activity: Gram-positive  &  Gram-negative
Description: A.J. Kempf, et al. "L-681,217, A New Novel Member of the Efrtotomycin Family of Antibiotics" Programs and abstracts of the 22St Interscience Conference on Antimicrobial Agents and Chemotherapy. Miami Beach. Florida. American Society for Microbiology. 1982.
Institute where first reported: Merck and Co
Year first mentioned: 1982
Highest developmental phase: Preclinical
Development status: Inactive
Chemical structure(s):
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Molecular weight: 659.81
Iso. SMILES: CCC(C(=O)NC/C=C/C=C(\C)/C(C(C)C1CC(C(O1)/C=C/C=C/C=C/C(=O)O)O)OC)C2(CC(C(C(O2)/C=C/C=C/C)(C)O)O)O
InChI Key: OSKAZZUZQORABG-UQKUNJBPSA-N
Can. SMILES: C/C=C/C=C/C1C(C)(C(CC(C(CC)C(=O)NC/C=C/C=C(\C)/C(C(C)C2CC(C(/C=C/C=C/C=C/C(=O)O)O2)O)OC)(O)O1)O)O
InChI: InChI=1S/C36H53NO10/c1-7-9-12-19-31-35(5,43)30(39)23-36(44,47-31)26(8-2)34(42)37-21-16-15-17-24(3)33(45-6)25(4)29-22-27(38)28(46-29)18-13-10-11-14-20-32(40)41/h7,9-20,25-31,33,38-39,43-44H,8,21-23H2,1-6H3,(H,37,42)(H,40,41)/b9-7+,11-10+,16-15+,18-13+,19-12+,20-14+,24-17+

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