Navigation

name Structure Reference Source Properties Activities Metabolism

Haplamine

AlkaPlorer ID: AK009001

Synonym: None

IUPAC Name: 9-methoxy-2,2-dimethyl-6H-pyrano[3,2-c]quinolin-5-one

Structure

SMILES: COC1=CC=C2NC(=O)C3=C(OC(C)(C)C=C3)C2=C1

copy

InChI: InChI=1S/C15H15NO3/c1-15(2)7-6-10-13(19-15)11-8-9(18-3)4-5-12(11)16-14(10)17/h4-8H,1-3H3,(H,16,17)

copy

InChIKey: IXRKDGGGFFCRIR-UHFFFAOYSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 257.289

TPSA？: 51.32000000000001

MolLogP？: 2.720900000000001

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Botrytis cinerea Botrytis cinerea GI nan None 10.1021/jf051478v
Colletotrichum acutatum Colletotrichum acutatum GI nan None 10.1021/jf051478v
Colletotrichum fragariae Colletotrichum fragariae GI nan None 10.1021/jf051478v
Colletotrichum gloeosporioides Colletotrichum gloeosporioides GI nan None 10.1021/jf051478v
Diaporthe ampelina Diaporthe ampelina GI nan None 10.1021/jf051478v
Fusarium oxysporum Fusarium oxysporum GI nan None 10.1021/jf051478v
Homo sapiens 15-hydroxyprostaglandin dehydrogenase [NAD+] Potency 19952.6 nM None
Homo sapiens 15-hydroxyprostaglandin dehydrogenase [NAD+] Potency 31622.8 nM None
Homo sapiens Aldehyde dehydrogenase 1A1 Potency 25118.9 nM None
Homo sapiens Aldehyde dehydrogenase 1A1 Potency 31622.8 nM None
Homo sapiens ATPase family AAA domain-containing protein 5 Potency 2059.6 nM None
Homo sapiens Bromodomain adjacent to zinc finger domain protein 2B Potency 89125.1 nM None
Homo sapiens Cellular tumor antigen p53 Potency 44668.4 nM None
Homo sapiens Chromobox protein homolog 1 Potency 100000.0 nM None
Homo sapiens Cytochrome P450 2C19 Potency 7943.3 nM None
Homo sapiens Cytochrome P450 2C9 Potency 25118.9 nM None
Homo sapiens Endoplasmic reticulum-associated amyloid beta-peptide-binding protein Potency 25118.9 nM None
Homo sapiens Geminin Potency 20596.2 nM None
Homo sapiens Glucagon-like peptide 1 receptor Potency 7943.3 nM None
Homo sapiens Glucagon-like peptide 1 receptor Potency 25118.9 nM None
Homo sapiens HepG2 Potency 3548.1 nM None
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 39810.7 nM None
Homo sapiens Huntingtin Potency 2818.4 nM None
Homo sapiens Isocitrate dehydrogenase [NADP] cytoplasmic Potency 20596.2 nM None
Homo sapiens Lysine-specific demethylase 4D-like Potency 5011.9 nM None
Homo sapiens Lysine-specific demethylase 4D-like Potency 31622.8 nM None
Homo sapiens Lysine-specific demethylase 4D-like Potency 35481.3 nM None
Homo sapiens Menin/Histone-lysine N-methyltransferase MLL Potency 39810.7 nM None
Homo sapiens microRNA 21 Potency 18492.7 nM None
Homo sapiens Mothers against decapentaplegic homolog 3 Potency 12589.3 nM None
Homo sapiens Muscleblind-like protein 1 Potency 25118.9 nM None
Homo sapiens Nuclear factor erythroid 2-related factor 2 Potency 8199.5 nM None
Homo sapiens Nuclear factor erythroid 2-related factor 2 Potency 11582.1 nM None
Homo sapiens Prelamin-A/C Potency 35481.3 nM None
Homo sapiens Sphingomyelin phosphodiesterase Potency 31622.8 nM None
Homo sapiens Thyroid stimulating hormone receptor Potency 5011.9 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 3662.6 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 11885.6 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 14581.0 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 14963.1 nM None
Human immunodeficiency virus 1 Aberrant vpr protein Potency 3162.3 nM None
Mus musculus Nuclear receptor ROR-gamma Potency 19952.6 nM None
Mus musculus Nuclear receptor ROR-gamma Potency 25118.9 nM None
Mus musculus Nuclear receptor ROR-gamma Potency 35481.3 nM None
Phomopsis obscurans Phomopsis obscurans GI nan None 10.1021/jf051478v
Phomopsis obscurans Phomopsis obscurans Inhibition 80.0 % 10.1021/jf051478v
Planktothrix agardhii Planktothrix agardhii Activity 100.0 uM 10.1021/jf051478v
Planktothrix agardhii Planktothrix agardhii IC50 nan None 10.1021/jf051478v
Planktothrix perornata Planktothrix perornata Activity 1.0 uM 10.1021/jf051478v
Planktothrix perornata Planktothrix perornata Activity 10.0 uM 10.1021/jf051478v
Planktothrix perornata Planktothrix perornata IC50 1800.0 nM 10.1021/jf051478v
Pseudanabaena sp. Pseudanabaena sp. Activity 1.0 uM 10.1021/jf051478v
Pseudanabaena sp. Pseudanabaena sp. Activity 100.0 uM 10.1021/jf051478v
Pseudanabaena sp. Pseudanabaena sp. IC50 2000.0 nM 10.1021/jf051478v
Selenastrum capricornutum Selenastrum capricornutum Activity 10.0 uM 10.1021/jf051478v
Selenastrum capricornutum Selenastrum capricornutum Activity 100.0 uM 10.1021/jf051478v
Selenastrum capricornutum Selenastrum capricornutum IC50 15900.0 nM 10.1021/jf051478v
None NON-PROTEIN TARGET AC50 14750.0 nM None
None No relevant target AC50 10370.0 nM None
None No relevant target Solubility 87100.0 nM 10.6019/CHEMBL3301361
None Unchecked AC50 3860.0 nM None
None Unchecked AC50 5320.0 nM None
None Unchecked AC50 5530.0 nM None
None Unchecked Potency 5011.9 nM None
None Unchecked Potency 11220.2 nM None
None Unchecked Potency 12589.3 nM None
None Unchecked Potency 20596.2 nM None

Metabolism Information