General Information of the Compound
| Compound ID |
CP0388868
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| Compound Name |
[(2R)-3-[[(2R)-2-amino-3-hydroxypropoxy]-hydroxyphosphoryl]oxy-2-hydroxypropyl] (Z)-octadec-9-enoate
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| Structure |
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| Formula |
C24H48NO8P
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| Molecular Weight |
509.621
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| Canonical SMILES |
CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@@H](O)COP(O)(=O)OC[C@H](N)CO
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| InChI |
InChI=1S/C24H48NO8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(28)31-20-23(27)21-33-34(29,30)32-19-22(25)18-26/h9-10,22-23,26-27H,2-8,11-21,25H2,1H3,(H,29,30)/b10-9-/t22-,23-/m1/s1
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| InChIKey |
KWNLRMSDTHZRLU-XSZXJSRZSA-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