General Information of the Compound
| Compound ID |
CP0404406
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| Compound Name |
2-[(2,5,7,8-tetramethyl-2-tetradecoxycarbonyl-3,4-dihydrochromen-6-yl)oxy]acetic acid
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| Structure |
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| Formula |
C30H48O6
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| Molecular Weight |
504.708
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| Canonical SMILES |
CCCCCCCCCCCCCCOC(=O)C1(C)CCc2c(C)c(OCC(O)=O)c(C)c(C)c2O1
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| InChI |
InChI=1S/C30H48O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-20-34-29(33)30(5)19-18-25-24(4)27(35-21-26(31)32)22(2)23(3)28(25)36-30/h6-21H2,1-5H3,(H,31,32)
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| InChIKey |
MPFYKLBCIDCZJG-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