General Information of the Compound
| Compound ID |
CP0388861
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| Compound Name |
(2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-[[(Z)-octadec-9-enoyl]amino]propoxy]phosphoryl]oxypropanoic acid
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| Structure |
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| Formula |
C24H47N2O8P
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| Molecular Weight |
522.62
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| Canonical SMILES |
CCCCCCCC\C=C/CCCCCCCC(=O)NC[C@@H](O)COP(O)(=O)OC[C@H](N)C(O)=O
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| InChI |
InChI=1S/C24H47N2O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)26-18-21(27)19-33-35(31,32)34-20-22(25)24(29)30/h9-10,21-22,27H,2-8,11-20,25H2,1H3,(H,26,28)(H,29,30)(H,31,32)/b10-9-/t21-,22+/m1/s1
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| InChIKey |
GLHIIVPBKPMJFL-YFKVPUFHSA-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