COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL566241
Chemical Name: (5alpha,8xi,9xi,14xi,16xi,17xi,22R)-26-(beta-D-glucopyranosyloxy)-22-hydroxyfurostan-3-yl6-deoxy-alpha-L-mannopyranosyl-(1->4)-[alpha-L-mannopyranosyl-(1->2)]-beta-D-glucopyranoside
Smiles: OC[C@H]1O[C@@H](OC2CC[C@]3([C@H](C2)CCC2C3CC[C@]3(C2CC2C3[C@H](C)[C@@](O2)(O)CCC(CO[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)C)C)C)[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O)O[C@

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Molecular Weight: 1067.23
Empirical Formula: C51H86O23

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 0.898
Rotatable bonds: 9
H-donors: 14
H-acceptors: 23
PSA: 366
Number of rings: 9

     

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