General Information of the Compound
| Compound ID |
CP0138954
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| Compound Name |
(E)-2-methoxy-4-(2-nitrovinyl)phenol
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| Synonyms |
(E)-2-methoxy-4-(2-nitrovinyl)phenol
1-(4-HYDROXY-3-METHOXYPHENYL)-2-NITROETHENE
2-Methoxy-4-(2-nitro-vinyl)-phenol
2-Methoxy-4-[(E)-2-nitroethenyl]phenol
2-methoxy-4-(2-nitroethenyl)phenol
2-methoxy-4-(2-nitrovinyl)phenol
2-methoxy-4-[(E)-2-nitrovinyl]phenol
22568-51-0
4-((1E)-2-nitrovinyl)-2-methoxyphenol
4-Hydroxy-3-methoxy-beta-nitrostyrene
4-{2-nitrovinyl}-2-methoxyphenol
6178-42-3
AC1LCWDN
AC1Q1WR9
AF-467/00017042
CHEMBL309016
MLS000574924
PubChem19447
trans-4-Hydroxy-3-methoxy-beta-nitrostyrene
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| Structure |
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| Formula |
C9H9NO4
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| Molecular Weight |
195.174
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| Canonical SMILES |
COc1cc(\C=C\[N+]([O-])=O)ccc1O
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| InChI |
InChI=1S/C9H9NO4/c1-14-9-6-7(2-3-8(9)11)4-5-10(12)13/h2-6,11H,1H3/b5-4+
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| InChIKey |
XVXCSPJSXIUNQJ-SNAWJCMRSA-N
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| CAS |
6178-42-3
22568-51-0
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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
Protein ID: PT00922, Epidermal growth factor receptor
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT02021, Transitional endoplasmic reticulum ATPase
Clinical Information about the Compound