General Information of the Compound
| Compound ID |
CP0501015
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| Compound Name |
10-Acetyl-1,8-dihydroxy-10H-anthracen-9-one
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| Synonyms |
1,8-Dihydroxy-10-acetylanthrone
1,8-dihydroxy-10-acetyl anthrone
10-Acetyl dithranol
10-Acetyl-1,8-dihydroxy-10H-anthracen-9-one
10-Acetylanthraline
3022-61-5
9(10H)-Anthracenone, 10-acetyl-1,8-dihydroxy-
AC1MIVB6
BDBM50060870
CCRIS 2039
CHEMBL339332
DTXSID30184322
JLVFGQSHNYEUIN-UHFFFAOYSA-N
SCHEMBL10630399
ZINC13606543
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| Structure |
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| Formula |
C16H12O4
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| Molecular Weight |
268.268
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| Canonical SMILES |
CC(=O)C1c2cccc(O)c2C(=O)c2c(O)cccc12
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| InChI |
InChI=1S/C16H12O4/c1-8(17)13-9-4-2-6-11(18)14(9)16(20)15-10(13)5-3-7-12(15)19/h2-7,13,18-19H,1H3
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| InChIKey |
JLVFGQSHNYEUIN-UHFFFAOYSA-N
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| CAS |
3022-61-5
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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
Clinical Information about the Compound