General Information of the Compound
| Compound ID |
CP0070044
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| Compound Name |
US9353075, 58
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| Structure |
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| Formula |
C19H27NO4
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| Molecular Weight |
333.428
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| Canonical SMILES |
CC(C)(C)[C@@H]1OC(=O)[C@@H]1NC(=O)OCCCCCc1ccccc1
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| InChI |
InChI=1S/C19H27NO4/c1-19(2,3)16-15(17(21)24-16)20-18(22)23-13-9-5-8-12-14-10-6-4-7-11-14/h4,6-7,10-11,15-16H,5,8-9,12-13H2,1-3H3,(H,20,22)/t15-,16-/m1/s1
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| InChIKey |
PLWIMGIXSCULIN-HZPDHXFCSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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