Ianthelliformisamine A
AlkaPlorer ID: AK112022
Synonym: None
IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3-(3,5-dibromo-4-methoxyphenyl)prop-2-enamide
Structure
SMILES: COC1=C(Br)C=C(C=CC(=O)NCCCNCCCCNCCCN)C=C1Br
InChI: InChI=1S/C20H32Br2N4O2/c1-28-20-17(21)14-16(15-18(20)22)6-7-19(27)26-13-5-12-25-10-3-2-9-24-11-4-8-23/h6-7,14-15,24-25H,2-5,8-13,23H2,1H3,(H,26,27)
InChIKey: KVQQKKIHZWAGNU-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Suberea ianthelliformis | Suberea | Aplysinellidae | Verongiida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 520.3100000000004
TPSA？: 88.41
MolLogP？: 3.047900000000001
Number of H-Donors: 4
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|