Agelenopsis aperta Indoleacetylpentamine toxins; Agel 416a, N2,4-Dihydroxy
AlkaPlorer ID: AK136438
Synonym: Agel 448a, AG 448a
IUPAC Name: N-[3-[3-[3-(4-aminobutylamino)propylamino]propyl-hydroxyamino]propyl]-2-(4-hydroxy-1H-indol-3-yl)acetamide
Structure
SMILES: NCCCCNCCCNCCCN(O)CCCNC(=O)CC1=CNC2=CC=CC(O)=C12
InChI: InChI=1S/C23H40N6O3/c24-9-1-2-10-25-11-4-12-26-13-5-15-29(32)16-6-14-27-22(31)17-19-18-28-20-7-3-8-21(30)23(19)20/h3,7-8,18,25-26,28,30,32H,1-2,4-6,9-17,24H2,(H,27,31)
InChIKey: FGOPYFNIVXXNNS-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agelenopsis aperta | Agelenopsis | Agelenidae | Araneae | Arachnida | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 448.6120000000002
TPSA？: 138.67
MolLogP？: 1.3118000000000023
Number of H-Donors: 7
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|