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name Structure Reference Source Properties Activities Metabolism

3-hydroxy-5-methylisoxazole

AlkaPlorer ID: AK271559

Synonym: None

IUPAC Name: 5-methyl-1,2-oxazol-3-one

Structure

SMILES: CC1=CC(O)=NO1

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InChI: InChI=1S/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6)

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InChIKey: KGVPNLBXJKTABS-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 99.089

TPSA？: 46.260000000000005

MolLogP？: 0.6886199999999998

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Alternaria alternata Alternaria alternata GI 74.0 % 10.1584/jpestics.D11-004
Alternaria alternata Alternaria alternata GI 82.3 % 10.1248/cpb.55.1755
Alternaria alternata Alternaria alternata GI 100.0 % 10.1248/cpb.55.1755
Alternaria alternata Alternaria alternata Inhibition 68.8 % 10.1016/j.ejmech.2011.02.035
Alternaria alternata Alternaria alternata Inhibition 70.85 % 10.1016/j.bmcl.2010.10.084
Alternaria alternata Alternaria alternata MIC 12.5 ug.mL-1 10.1021/jf300146n
Alternaria alternata Alternaria alternata MIC50 38.3 ug.mL-1 10.1016/j.bmcl.2020.127220
Alternaria brassicae Alternaria brassicae GI 89.0 % 10.1248/cpb.55.1755
Alternaria brassicae Alternaria brassicae GI 100.0 % 10.1248/cpb.55.1755
Alternaria brassicae Alternaria brassicae Inhibition 47.1 % 10.1016/j.ejmech.2011.02.035
Alternaria brassicae Alternaria brassicae Inhibition 58.03 % 10.1016/j.bmcl.2010.10.084
Alternaria kikuchiana Alternaria kikuchiana Activity 81.8 % 10.3390/molecules16075618
Alternaria mali Alternaria mali Activity 85.7 % 10.3390/molecules16075618
Alternaria solani Alternaria solani Activity 88.2 % 10.3390/molecules16075618
Alternaria solani Alternaria solani GI 80.3 % 10.1021/jf3053934
Alternaria solani Alternaria solani IC50 14.03 ug.mL-1 10.1021/jf3053934
Alternaria solani Alternaria solani MIC 12.5 ug.mL-1 10.1021/jf300146n
Aspergillus oryzae Aspergillus oryzae MIC50 45.7 ug.mL-1 10.1016/j.bmcl.2020.127220
Bipolaris maydis Bipolaris maydis Activity 34.8 % 10.3390/molecules16075618
Bipolaris sorokiniana Bipolaris sorokiniana GI 37.1 % 10.1248/cpb.55.1755
Bipolaris sorokiniana Bipolaris sorokiniana GI 100.0 % 10.1248/cpb.55.1755
Bipolaris sorokiniana Bipolaris sorokiniana Inhibition 61.89 % 10.1016/j.bmcl.2010.10.084
Botrytis cinerea Botrytis cinerea Activity 70.4 % 10.3390/molecules16075618
Botrytis cinerea Botrytis cinerea EC50 4.6 ug.mL-1 10.1016/j.bmc.2007.03.037
Botrytis cinerea Botrytis cinerea EC50 5.12 ug.mL-1 10.1016/j.bmc.2008.02.006
Botrytis cinerea Botrytis cinerea EC50 25.23 ug.mL-1 10.3390/molecules16119129
Botrytis cinerea Botrytis cinerea GI 100.0 % 10.1021/jf3053934
Botrytis cinerea Botrytis cinerea IC50 8.92 ug.mL-1 10.1021/jf3053934
Botrytis cinerea Botrytis cinerea Inhibition 75.4 % 10.1016/j.bmc.2007.04.014
Botrytis cinerea Botrytis cinerea MIC 12.5 ug.mL-1 10.1021/jf300146n
Ceratobasidium cereale Ceratobasidium cereale Activity 25.0 % 10.3390/molecules16075618
Cercospora beticola Cercospora beticola GI 88.0 % 10.1584/jpestics.D11-004
Cladosporium cladosporioides Cladosporium cladosporioides MIC50 28.9 ug.mL-1 10.1016/j.bmcl.2020.127220
Colletotrichum gloeosporioides Colletotrichum gloeosporioides EC50 15.8 ug.mL-1 10.1016/j.bmc.2007.03.037
Colletotrichum gloeosporioides Colletotrichum gloeosporioides EC50 15.8 ug.mL-1 10.1016/j.bmc.2008.02.006
Colletotrichum gloeosporioides Colletotrichum gloeosporioides EC50 37.58 ug.mL-1 10.3390/molecules16119129
Colletotrichum gloeosporioides Colletotrichum gloeosporioides GI 49.21 % 10.1021/jf3053934
Colletotrichum gloeosporioides Colletotrichum gloeosporioides IC50 100.0 ug.mL-1 10.1021/jf3053934
Colletotrichum gloeosporioides Colletotrichum gloeosporioides MIC 12.5 ug.mL-1 10.1021/jf300146n
Cytospora Cytospora EC50 21.4 ug.mL-1 10.1016/j.bmc.2007.03.037
Cytospora Cytospora EC50 21.4 ug.mL-1 10.1016/j.bmc.2008.02.006
Cytospora Cytospora EC50 39.26 ug.mL-1 10.3390/molecules16119129
Cytospora Cytospora GI 38.94 % 10.1021/jf3053934
Cytospora Cytospora IC50 100.0 ug.mL-1 10.1021/jf3053934
Cytospora Cytospora Inhibition 52.02 % 10.1016/j.bmc.2008.02.006
Cytospora Cytospora Inhibition 57.3 % 10.3390/molecules16119129
Cytospora Cytospora Inhibition 91.2 % 10.1016/j.bmc.2007.03.037
Fusarium fujikuroi Fusarium fujikuroi Activity 40.0 % 10.3390/molecules16075618
Fusarium graminearum Fusarium graminearum Activity 33.3 % 10.3390/molecules16075618
Fusarium graminearum Fusarium graminearum EC50 26.4 ug.mL-1 10.1016/j.bmc.2007.03.037
Fusarium graminearum Fusarium graminearum EC50 26.4 ug.mL-1 10.1016/j.bmc.2008.02.006
Fusarium graminearum Fusarium graminearum GI 38.7 % 10.1248/cpb.55.1755
Fusarium graminearum Fusarium graminearum GI 45.0 % 10.1584/jpestics.D11-004
Fusarium graminearum Fusarium graminearum GI 99.4 % 10.1248/cpb.55.1755
Fusarium graminearum Fusarium graminearum Inhibition 50.4 % 10.1016/j.ejmech.2018.03.076
Fusarium graminearum Fusarium graminearum Inhibition 52.9 % 10.1016/j.bmc.2007.04.014
Fusarium graminearum Fusarium graminearum Inhibition 53.68 % 10.1016/j.bmc.2008.02.006
Fusarium graminearum Fusarium graminearum Inhibition 57.0 % 10.1016/j.ejmech.2011.02.035
Fusarium graminearum Fusarium graminearum Inhibition 67.97 % 10.1016/j.bmcl.2010.10.084
Fusarium graminearum Fusarium graminearum Inhibition 100.0 % 10.1016/j.bmc.2007.03.037
Fusarium graminearum Fusarium graminearum MIC 12.5 ug.mL-1 10.1021/jf300146n
Fusarium oxysporum Fusarium oxysporum Activity 0.0411 mg/ml 10.1016/j.bmc.2007.03.037
Fusarium oxysporum Fusarium oxysporum Activity 0.85 mg/ml 10.1016/j.bmc.2007.03.037
Fusarium oxysporum Fusarium oxysporum Activity 6.0 % 10.1016/j.bmc.2007.03.037
Fusarium oxysporum Fusarium oxysporum EC50 27.93 ug.mL-1 10.3390/molecules16119129
Fusarium oxysporum Fusarium oxysporum EC50 29.1 ug.mL-1 10.1016/j.bmc.2007.03.037
Fusarium oxysporum Fusarium oxysporum EC50 29.1 ug.mL-1 10.1016/j.bmc.2007.04.014
Fusarium oxysporum Fusarium oxysporum EC50 29.1 ug.mL-1 10.1016/j.bmc.2008.02.006
Fusarium oxysporum Fusarium oxysporum Inhibition 52.11 % 10.1016/j.bmc.2008.02.006
Fusarium oxysporum Fusarium oxysporum Inhibition 55.4 % 10.1016/j.ejmech.2018.03.076
Fusarium oxysporum Fusarium oxysporum Inhibition 58.4 % 10.3390/molecules16119129
Fusarium oxysporum Fusarium oxysporum Inhibition 91.3 % 10.1016/j.bmc.2007.03.037
Fusarium oxysporum f. sp. cucumerinum Fusarium oxysporum f. sp. cucumerinum GI 19.8 % 10.1248/cpb.55.1755
Fusarium oxysporum f. sp. cucumerinum Fusarium oxysporum f. sp. cucumerinum GI 91.5 % 10.1248/cpb.55.1755
Fusarium oxysporum f. sp. niveum Fusarium oxysporum f. sp. niveum MIC 12.5 ug.mL-1 10.1021/jf300146n
Fusarium oxysporum f. sp. vasinfectum Fusarium oxysporum f. sp. vasinfectum GI 45.8 % 10.1248/cpb.55.1755
Fusarium oxysporum f. sp. vasinfectum Fusarium oxysporum f. sp. vasinfectum GI 92.3 % 10.1248/cpb.55.1755
Fusarium oxysporum f. sp. vasinfectum Fusarium oxysporum f. sp. vasinfectum Inhibition 62.7 % 10.1016/j.ejmech.2011.02.035
Fusarium oxysporum f. sp. vasinfectum Fusarium oxysporum f. sp. vasinfectum Inhibition 63.2 % 10.1016/j.bmcl.2010.10.084
Fusarium oxysporum f. sp. vasinfectum Fusarium oxysporum f. sp. vasinfectum MIC 25.0 ug.mL-1 10.1021/jf300146n
Fusarium solani Fusarium solani GI 72.45 % 10.1021/jf3053934
Fusarium solani Fusarium solani IC50 38.49 ug.mL-1 10.1021/jf3053934
Fusarium solani Fusarium solani MIC 50.0 ug.mL-1 10.1021/jf300146n
Fusarium solani Fusarium solani MIC50 15.6 ug.mL-1 10.1016/j.bmcl.2020.127220
Gaeumannomyces graminis Gaeumannomyces graminis GI 56.0 % 10.1584/jpestics.D11-004
Geotrichum candidum Geotrichum candidum MIC50 50.0 ug.mL-1 10.1016/j.bmcl.2020.127220
Homo sapiens 786-0 GI50 100000.0 nM None
Homo sapiens A549 GI50 100000.0 nM None
Homo sapiens ACHN GI50 18923.44 nM None
Homo sapiens BT-549 GI50 100000.0 nM None
Homo sapiens CAKI-1 GI50 100000.0 nM None
Homo sapiens COLO 205 GI50 100000.0 nM None
Homo sapiens EKVX GI50 100000.0 nM None
Homo sapiens HCC 2998 GI50 100000.0 nM None
Homo sapiens HCT-116 GI50 100000.0 nM None
Homo sapiens HCT-15 GI50 100000.0 nM None
Homo sapiens HOP-62 GI50 100000.0 nM None
Homo sapiens HOP-92 GI50 100000.0 nM None
Homo sapiens Hs-578T GI50 100000.0 nM None
Homo sapiens HT-29 GI50 100000.0 nM None
Homo sapiens IGROV-1 GI50 100000.0 nM None
Homo sapiens K562 GI50 100000.0 nM None
Homo sapiens LOX IMVI GI50 100000.0 nM None
Homo sapiens M14 GI50 100000.0 nM None
Homo sapiens MCF7 GI50 100000.0 nM None
Homo sapiens MDA-MB-231 GI50 100000.0 nM None
Homo sapiens MDA-MB-435 GI50 100000.0 nM None
Homo sapiens NCI/ADR-RES GI50 100000.0 nM None
Homo sapiens NCI-H226 GI50 100000.0 nM None
Homo sapiens NCI-H23 GI50 100000.0 nM None
Homo sapiens NCI-H322M GI50 100000.0 nM None
Homo sapiens NCI-H460 GI50 100000.0 nM None
Homo sapiens NCI-H522 GI50 100000.0 nM None
Homo sapiens OVCAR-3 GI50 100000.0 nM None
Homo sapiens OVCAR-4 GI50 100000.0 nM None
Homo sapiens OVCAR-5 GI50 100000.0 nM None
Homo sapiens OVCAR-8 GI50 100000.0 nM None
Homo sapiens PC-3 GI50 100000.0 nM None
Homo sapiens RPMI-8226 GI50 100000.0 nM None
Homo sapiens RXF 393 GI50 100000.0 nM None
Homo sapiens SF-268 GI50 100000.0 nM None
Homo sapiens SF-295 GI50 100000.0 nM None
Homo sapiens SF-539 GI50 100000.0 nM None
Homo sapiens SK-MEL-2 GI50 100000.0 nM None
Homo sapiens SK-MEL-28 GI50 100000.0 nM None
Homo sapiens SK-OV-3 GI50 100000.0 nM None
Homo sapiens SNB-19 GI50 100000.0 nM None
Homo sapiens SNB-75 GI50 100000.0 nM None
Homo sapiens SW-620 GI50 100000.0 nM None
Homo sapiens TK-10 GI50 100000.0 nM None
Homo sapiens U-251 GI50 100000.0 nM None
Homo sapiens UACC-257 GI50 100000.0 nM None
Homo sapiens UACC-62 GI50 100000.0 nM None
Homo sapiens UO-31 GI50 100000.0 nM None
Macrophoma Macrophoma Activity 50.0 % 10.3390/molecules16075618
Microdochium nivale Microdochium nivale GI 77.0 % 10.1584/jpestics.D11-004
Mycosphaerella arachidis Mycosphaerella arachidis Activity 93.3 % 10.3390/molecules16075618
Paecilomyces variotii Paecilomyces variotii MIC50 57.2 ug.mL-1 10.1016/j.bmcl.2020.127220
Penicillium ochrochloron Penicillium ochrochloron MIC50 62.2 ug.mL-1 10.1016/j.bmcl.2020.127220
Phytophthora infestans Phytophthora infestans Activity 36.4 % 10.3390/molecules16075618
Phytophthora infestans Phytophthora infestans EC50 25.1 ug.mL-1 10.1016/j.bmc.2007.03.037
Phytophthora infestans Phytophthora infestans EC50 25.1 ug.mL-1 10.1016/j.bmc.2008.02.006
Phytophthora infestans Phytophthora infestans EC50 26.49 ug.mL-1 10.3390/molecules16119129
Pyrenophora graminea Pyrenophora graminea GI 80.0 % 10.1584/jpestics.D11-004
Pyricularia oryzae Pyricularia oryzae GI 66.4 % 10.1248/cpb.55.1755
Pyricularia oryzae Pyricularia oryzae GI 100.0 % 10.1248/cpb.55.1755
Pyricularia oryzae Pyricularia oryzae Inhibition 53.5 % 10.1016/j.ejmech.2011.02.035
Pyricularia oryzae Pyricularia oryzae Inhibition 75.11 % 10.1016/j.bmcl.2010.10.084
Rhizoctonia solani Rhizoctonia solani Activity 63.5 % 10.3390/molecules16075618
Rhizoctonia solani Rhizoctonia solani EC50 38.64 ug.mL-1 10.3390/molecules16119129
Rhizoctonia solani Rhizoctonia solani EC50 52.1 ug.mL-1 10.1016/j.bmc.2007.03.037
Rhizoctonia solani Rhizoctonia solani EC50 52.1 ug.mL-1 10.1016/j.bmc.2007.04.014
Rhizoctonia solani Rhizoctonia solani EC50 52.1 ug.mL-1 10.1016/j.bmc.2008.02.006
Rhizoctonia solani Rhizoctonia solani GI 28.0 % 10.1584/jpestics.D11-004
Rhynchosporium secalis Rhynchosporium secalis GI 100.0 % 10.1584/jpestics.D11-004
Sclerotinia sclerotiorum Sclerotinia sclerotiorum Activity 0.13 mg/ml 10.1016/j.bmc.2008.02.006
Sclerotinia sclerotiorum Sclerotinia sclerotiorum Activity 0.91 mg/ml 10.1016/j.bmc.2008.02.006
Sclerotinia sclerotiorum Sclerotinia sclerotiorum Activity 66.7 % 10.3390/molecules16075618
Sclerotinia sclerotiorum Sclerotinia sclerotiorum EC50 4.63 ug.mL-1 10.1016/j.bmc.2008.02.006
Sclerotinia sclerotiorum Sclerotinia sclerotiorum EC50 5.1 ug.mL-1 10.1016/j.bmc.2007.03.037
Sclerotinia sclerotiorum Sclerotinia sclerotiorum EC50 7.76 ug.mL-1 10.3390/molecules16119129
Sclerotinia sclerotiorum Sclerotinia sclerotiorum Inhibition 77.5 % 10.1016/j.bmc.2007.04.014
Sclerotinia sclerotiorum Sclerotinia sclerotiorum MIC50 26.5 ug.mL-1 10.1016/j.bmcl.2020.127220
Sclerotinia sclerotiorum Sclerotinia sclerotiorum permeability 24.6 % 10.1016/j.bmc.2008.02.006
Thanatephorus cucumeris Thanatephorus cucumeris Activity 78.4 % 10.3390/molecules16075618
Thanatephorus cucumeris Thanatephorus cucumeris EC50 32.21 ug.mL-1 10.3390/molecules16119129
Thanatephorus cucumeris Thanatephorus cucumeris EC50 40.4 ug.mL-1 10.1016/j.bmc.2007.03.037
Thanatephorus cucumeris Thanatephorus cucumeris EC50 40.4 ug.mL-1 10.1016/j.bmc.2008.02.006
Valsa mali Valsa mali Inhibition 22.5 % 10.1016/j.ejmech.2018.03.076
Zymoseptoria tritici Zymoseptoria tritici GI 86.0 % 10.1584/jpestics.D11-004
None Molecular identity unknown Inhibition 59.95 % 10.1016/j.bmcl.2010.10.084
None Unchecked Activity 0.124 mg/ml 10.1016/j.bmc.2008.02.006

Metabolism Information