COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL036674
Chemical Name: [(2S,3R,4Z,6E,9R,11S,12R,13R,14S)-12-{[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyl]oxy}-2-ethyl-11-formyl-14-hydroxy-5,9,13-trimethyl-8,
Smiles: O=C[C@H]1C[C@@H](C)C(=O)/C=C/C(=C\[C@@H]([C@H](OC(=O)C[C@H]([C@H]([C@H]1O[C@@H]1O[C@H](C)[C@H]([C@@H]([C@H]1O)N(C)C)O[C@@H]1O[C@@H](C)[C@@H]([C@](C1)(C)O)O)C)O)CC)CO[C@H]1O[C@@H](C)[C@@H]([C@@H]([C@@H

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Saltdata: HOOCCH2(OH)CH2(OH)COOH
Molecular Weight: 902.1
Empirical Formula: C45H75NO17

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 0
Rotatable bonds: 0
H-donors: 0
H-acceptors: 0
PSA: 0
Number of rings: 0

     

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