Muscaaurin I
AlkaPlorer ID: AK307079
Synonym: 4-[[[Carboxy(2,3-dihydro-3-oxo-5-isoxazolyl)methyl]imino]ethylidene]-1,2,3,4-tetrahydro-2,6-pyridinedicarboxylic acid
IUPAC Name: 4-[2-[carboxy-(3-oxo-1,2-oxazol-5-yl)methyl]iminoethylidene]-2,3-dihydro-1H-pyridine-2,6-dicarboxylic acid
Structure
SMILES: O=C(O)C1=CC(=CC=NC(C(=O)O)C2=CC(O)=NO2)CC(C(=O)O)N1
InChI: InChI=1S/C14H13N3O8/c18-10-5-9(25-17-10)11(14(23)24)15-2-1-6-3-7(12(19)20)16-8(4-6)13(21)22/h1-3,5,8,11,16H,4H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)
InChIKey: AVQHQGYBRFPNMT-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Amanita muscaria | Amanita | Amanitaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 351.2710000000001
TPSA？: 182.55
MolLogP？: -0.0819
Number of H-Donors: 5
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|