2-Amino-5-hydroxy-1,4-naphthoquinone; N-(3-Carboxypropyl)
AlkaPlorer ID: AK254317
Synonym: 2-(3-Carboxypropylamino)-5-hydroxy-1,4-naphthalenedione, Juglonbutine
IUPAC Name: 4-[(5-hydroxy-1,4-dioxonaphthalen-2-yl)amino]butanoic acid
Structure
SMILES: O=C(O)CCCNC1=CC(=O)C2=C(O)C=CC=C2C1=O
InChI: InChI=1S/C14H13NO5/c16-10-4-1-3-8-13(10)11(17)7-9(14(8)20)15-6-2-5-12(18)19/h1,3-4,7,15-16H,2,5-6H2,(H,18,19)
InChIKey: DOLXBZOUEMTRRL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Juglans cathayensis | Juglans | Juglandaceae | Fagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 275.26000000000005
TPSA？: 103.70000000000002
MolLogP？: 1.1095000000000002
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|