Compound ID | 615

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GW 773546

Class: Macrolide

Agent Type: Semisynthetic; Small molecule;
Spectrum of activity: Gram-negative
Mechanism of action: Unknown
Target Pathogen: Active against erythromycin A-resistant Pseudomonas, and Haemophilus influenzae
Institute where first reported: Penn State Hershey Medical Centre, USA
Year first mentioned: 2004
Development status: Experimental
Chemical structure(s):
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Molecular weight: 827.04
Iso. SMILES: O=C1O[C@@]2([C@@H](CC)OC(=O)[C@@H](C(C([C@H]([C@](C[C@H](C(C([C@@]2([H])[C@@H]1NC(CSC3=CN=C4C=CC=CC4=N3)=C)C)=O)C)(C)OC)O[C@H]5[C@H](O)[C@@H](N(C)C)C[C@@H](C)O5)C)=O)C)C
InChI Key: ORGFQESSENDKMX-JKDIURGWSA-N
Can. SMILES: CC[C@@H]1[C@]2(C)[C@@]([H])(C(C)C(=O)[C@H](C)C[C@](C)([C@@H](C(C)C(=O)[C@@H](C)C(=O)O1)O[C@H]3[C@@H]([C@H](C[C@@H](C)O3)N(C)C)O)OC)[C@@H](C(=O)O2)NC(=C)CSC4=CN=C5C=CC=CC5=N4
InChI: InChI=1S/C43H62N4O10S/c1-13-31-43(9)33(34(40(52)57-43)45-23(3)21-58-32-20-44-28-16-14-15-17-29(28)46-32)25(5)35(48)22(2)19-42(8,53-12)38(26(6)36(49)27(7)39(51)55-31)56-41-37(50)30(47(10)11)18-24(4)54-41/h14-17,20,22,24-27,30-31,33-34,37-38,41,45,50H,3,13,18-19,21H2,1-2,4-12H3/t22-,24-,25?,26?,27-,30+,31-,33+,34+,37-,38-,41+,42-,43-/m1/s1
External links:
Citation: https://doi.org/10.1128/aac.48.11.4113-4119.2004

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