COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383350
Chemical Name: (12'Z,14'E,24'E)-5',17',19'-trihydroxy-23'-methoxy-2',4',12',16',18',20',22'-heptamethyl-1',4,6',11'-tetraoxo-1',2'-dihydro-6'H-spiro[1,3-dioxolane-2,9'-[2,7](epoxypentadeca[1,11,13]trienoimino)naphth
Smiles: COC1/C=C/OC2(C)Oc3c(C2=O)c2c(c(c3C)O)C(=O)C(=CC32OCC(=O)O3)NC(=O)/C(=C\C=C\C(C(C(C(C(C(C1C)OC(=O)C)C)O)C)O)C)/C

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Molecular Weight: 753.8
Empirical Formula: C39H47NO14

Available Amount: 0 mg

Lipinsky:
logP: 1.691
Rotatable bonds: 6
H-donors: 4
H-acceptors: 14
PSA: 213
Number of rings: 6

     

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