General Information of the Compound
| Compound ID |
CP0580176
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| Compound Name |
sodium;dispiro[cyclopropane-1,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene]-9'-yl phosphate
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| Structure |
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| Formula |
C34H26NaO4P
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| Molecular Weight |
552.542
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| Canonical SMILES |
[Na+].[O-]P(=O)(OC1=Cc2ccccc2C2(CC2)c2ccccc12)OC1=Cc2ccccc2C2(CC2)c2ccccc12
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| InChI |
InChI=1S/C34H27O4P.Na/c35-39(36,37-31-21-23-9-1-5-13-27(23)33(17-18-33)29-15-7-3-11-25(29)31)38-32-22-24-10-2-6-14-28(24)34(19-20-34)30-16-8-4-12-26(30)32;/h1-16,21-22H,17-20H2,(H,35,36);/q;+1/p-1
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| InChIKey |
GRPDYORCJFPSMD-UHFFFAOYSA-M
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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