General Information of the Compound
| Compound ID |
CP0580175
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| Compound Name |
sodium;bis(9-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl) phosphate
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| Structure |
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| Formula |
C30H22NaO4P
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| Molecular Weight |
500.466
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| Canonical SMILES |
[Na+].[O-]P(=O)(OC1=Cc2ccccc2Cc2ccccc12)OC1=Cc2ccccc2Cc2ccccc12
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| InChI |
InChI=1S/C30H23O4P.Na/c31-35(32,33-29-19-23-11-3-1-9-21(23)17-25-13-5-7-15-27(25)29)34-30-20-24-12-4-2-10-22(24)18-26-14-6-8-16-28(26)30;/h1-16,19-20H,17-18H2,(H,31,32);/q;+1/p-1
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| InChIKey |
NBZLLEQMCDSCRO-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