CAMPHENE

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Molecule Category Free-form
UNII G3VG94Z26E
Source Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...

Structure

InChI Key CRPUJAZIXJMDBK-UHFFFAOYSA-N
Smiles CC1(C)C2CCC(C2)C1=C
InChI
InChI=1S/C10H16/c1-7-8-4-5-9(6-8)10(7,2)3/h8-9H,1,4-6H2,2-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H16
Molecular Weight 136.23
AlogP 2.93
Hydrogen Bond Acceptor 0.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 0.0
Polar Surface Area 0.0
Molecular species None
Aromatic Rings 0.0
Heavy Atoms 10.0
Assay Description Organism Bioactivity Reference
Insecticidal activity against adult Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 96 hr relative to control Leptinotarsa decemlineata 76.7 %
Insecticidal activity against adult Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 48 hr relative to control Leptinotarsa decemlineata 76.7 %
Insecticidal activity against adult Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 24 hr relative to control Leptinotarsa decemlineata 73.3 %
Insecticidal activity against adult Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 12 hr relative to control Leptinotarsa decemlineata 30.0 %
Insecticidal activity against adult Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 96 hr relative to control Leptinotarsa decemlineata 13.3 %
Insecticidal activity against adult Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 48 hr relative to control Leptinotarsa decemlineata 13.3 %
Insecticidal activity against adult Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 24 hr relative to control Leptinotarsa decemlineata 13.3 %
Insecticidal activity against adult Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 12 hr relative to control Leptinotarsa decemlineata 6.7 %
Insecticidal activity against third-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 96 hr (Rvb = 3.3 +/- 3.3%) Leptinotarsa decemlineata 50.0 %
Insecticidal activity against third-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 48 hr (Rvb = 3.3 +/- 3.3%) Leptinotarsa decemlineata 46.7 %
Insecticidal activity against third-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 24 hr relative to control Leptinotarsa decemlineata 43.3 %
Insecticidal activity against third-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 12 hr relative to control Leptinotarsa decemlineata 16.7 %
Insecticidal activity against third-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 96 hr (Rvb = 3.3 +/- 3.3%) Leptinotarsa decemlineata 10.0 %
Insecticidal activity against third-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 48 hr (Rvb = 3.3 +/- 3.3%) Leptinotarsa decemlineata 6.7 %
Insecticidal activity against third-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 24 hr relative to control Leptinotarsa decemlineata 0.0 %
Insecticidal activity against third-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 12 hr relative to control Leptinotarsa decemlineata 0.0 %
Insecticidal activity against first-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 48 hr relative to control Leptinotarsa decemlineata 6.7 %
Insecticidal activity against first-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 96 hr relative to control Leptinotarsa decemlineata 26.7 %
Insecticidal activity against first-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 48 hr relative to control Leptinotarsa decemlineata 23.3 %
Insecticidal activity against first-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 24 hr relative to control Leptinotarsa decemlineata 23.3 %
Insecticidal activity against first-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 20 mg after 12 hr relative to control Leptinotarsa decemlineata 13.3 %
Insecticidal activity against first-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 96 hr relative to control Leptinotarsa decemlineata 10.0 %
Insecticidal activity against first-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 24 hr relative to control Leptinotarsa decemlineata 0.0 %
Insecticidal activity against first-instar larval stage of Leptinotarsa decemlineata infested potato leaves assessed as mortality at 10 mg after 12 hr relative to control Leptinotarsa decemlineata 0.0 %
Contact insecticidal activity against cotton leafworm Spodoptera littoralis third-instar larvae exposed to 1 mg/larva compound application through dorsum of larvae followed by feeding on fresh castor bean leaves assessed as insect mortality after 24 hr Spodoptera littoralis None
Fumigant insecticidal activity against cotton leafworm Spodoptera littoralis third-instar larvae fed on fresh castor bean leaves assessed as insect mortality after 24 hr Spodoptera littoralis 100.0 ug.mL-1
Fumigant molluscicidal activity against Theba pisana (white garden snail) assessed as snail mortality after 24 hr Theba pisana 33.53 ug.mL-1
Contact molluscicidal activity against Theba pisana (white garden snail ) exposed to compound throgh application to surface of snail body inside shell assessed as compound level per snail causing snail mortality after 24 hr Theba pisana 1000.0 ug
Induction of apoptosis in Homo sapiens (human) HeLa cells assessed as fragmented nuclei at 10 to 100 ug/ml after 24 hr by acridine orange/ethidium bromide-based inverted fluorescence microscopic analysis Homo sapiens None
Cytotoxicity against Homo sapiens (human) HeLa cells assessed as decrease in cell viability at 10 to 100 ug/ml after 24 hr by acridine orange/ethidium bromide-based inverted fluorescence microscopic analysis Homo sapiens None
Induction of necrosis in Homo sapiens (human) HeLa cells assessed as dissolution of cytoplasmic membrane at >50 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of necrosis in Homo sapiens (human) HeLa cells assessed as chromatin flocculation at >50 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of necrosis in Homo sapiens (human) HeLa cells assessed as dissolution of nuclear membrane at >50 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of necrosis in Homo sapiens (human) HeLa cells assessed as increase in cytoplasmic vacuolization at >50 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of necrosis in Homo sapiens (human) HeLa cells assessed as increase in cytoplasmic volume at >50 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of necrosis in Homo sapiens (human) HeLa cells assessed as increase in nucleus volume at >50 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of apoptosis in Homo sapiens (human) HeLa cells assessed as apoptotic bodies at <40 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of apoptosis in Homo sapiens (human) HeLa cells assessed as membrane blebbing at <40 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of apoptosis in Homo sapiens (human) HeLa cells assessed as detachment from substratum at <40 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of apoptosis in Homo sapiens (human) HeLa cells assessed as loss of cell to cell contact at <40 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Cytotoxicity against Homo sapiens (human) HeLa cells assessed as cell death at 10 to 100 ug/ml after 48 hr by light microscopic analysis Homo sapiens None
Induction of apoptosis in Homo sapiens (human) HeLa cells assessed as rounded cells at 10 to 100 ug/ml after 48 hr by light microscopic analysis Homo sapiens None
Induction of apoptosis in Homo sapiens (human) HeLa cells assessed as floating cells at 10 to 50 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Induction of apoptosis in Homo sapiens (human) HeLa cells assessed as rounded cells at 10 to 50 ug/ml after 24 hr by light microscopic analysis Homo sapiens None
Cytotoxicity against Homo sapiens (human) HeLa cells up to 3 days by MTT assay Homo sapiens None Cytotoxicity against Homo sapiens (human) HeLa cells up to 3 days by MTT assay Homo sapiens 38.54 ug.mL-1
Growth inhibition of Homo sapiens (human) HeLa cells at 10 to 30 ug/ml up to 3 days by MTT assay Homo sapiens 60.0 %

Cross References

Resources Reference
ChEMBL CHEMBL2268550
FDA SRS G3VG94Z26E
CONTENTS