Agaridoxin
AlkaPlorer ID: AK013634
Synonym: None
IUPAC Name: (2S)-2-amino-5-(3,4-dihydroxyanilino)-5-oxopentanoic acid
Structure
SMILES: N[C@@H](CCC(O)=NC1=CC=C(O)C(O)=C1)C(=O)O
InChI: InChI=1S/C11H14N2O5/c12-7(11(17)18)2-4-10(16)13-6-1-3-8(14)9(15)5-6/h1,3,5,7,14-15H,2,4,12H2,(H,13,16)(H,17,18)/t7-/m0/s1
InChIKey: HJLNKWYSKFDHDG-ZETCQYMHSA-N
Reference
PubChem CID: 15382847
CAS: 58298-77-4
LOTUS: LTS0094820
SuperNatural Ⅲ: SN0127325-01
{NPAtlas: NPA019766
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agaricus campestris | Agaricus | Agaricaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 254.242
TPSA？: 136.37
MolLogP？: 0.8778999999999999
Number of H-Donors: 5
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Mus musculus | B16 | ID50 | 0.27 | mM | 10.1021/jm00195a004 |