General Information of the Compound
| Compound ID |
CP0393620
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| Compound Name |
N'-hydroxy-N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]pentanediamide
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| Structure |
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| Formula |
C25H30N2O8
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| Molecular Weight |
486.521
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| Canonical SMILES |
COc1cc2CC[C@H](NC(=O)CCCC(=O)NO)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC
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| InChI |
InChI=1S/C25H30N2O8/c1-32-19-11-9-15-16(13-18(19)28)17(26-21(29)6-5-7-22(30)27-31)10-8-14-12-20(33-2)24(34-3)25(35-4)23(14)15/h9,11-13,17,31H,5-8,10H2,1-4H3,(H,26,29)(H,27,30)/t17-/m0/s1
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| InChIKey |
SCJHIANVXFDJFN-KRWDZBQOSA-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