General Information of the Compound
| Compound ID |
CP0482396
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| Compound Name |
[1-methoxy-3-(octoxycarbonylamino)propan-2-yl] octanoate
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| Structure |
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| Formula |
C21H41NO5
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| Molecular Weight |
387.561
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| Canonical SMILES |
CCCCCCCCOC(=O)NCC(COC)OC(=O)CCCCCCC
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| InChI |
InChI=1S/C21H41NO5/c1-4-6-8-10-12-14-16-26-21(24)22-17-19(18-25-3)27-20(23)15-13-11-9-7-5-2/h19H,4-18H2,1-3H3,(H,22,24)
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| InChIKey |
UTXGXXFGJDAVKZ-UHFFFAOYSA-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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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound