134850-51-4
AlkaPlorer ID: AK044395
Synonym: None
IUPAC Name: N-[2-(2-amino-1H-imidazol-5-yl)ethyl]-3-[4-(3-aminopropoxy)-3,5-dibromophenyl]-2-hydroxyiminopropanamide
Structure
SMILES: NCCCOC1=C(Br)C=C(CC(=NO)C(=O)NCCC2=CN=C(N)N2)C=C1Br
InChI: InChI=1S/C17H22Br2N6O3/c18-12-6-10(7-13(19)15(12)28-5-1-3-20)8-14(25-27)16(26)22-4-2-11-9-23-17(21)24-11/h6-7,9,27H,1-5,8,20H2,(H,22,26)(H3,21,23,24)
InChIKey: VZDKEGKTDBWXJY-UHFFFAOYSA-N
Reference
Three new bromotyrosine derivatives lethal to crab from the marine sponge, Pseudoceratina purpurea
PubChem CID: 23426997
LOTUS: LTS0219039
COCONUT: CNP0199417
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudoceratina purpurea | Pseudoceratina | Pseudoceratinidae | Verongiida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 518.2100000000003
TPSA？: 151.64
MolLogP？: 1.9761
Number of H-Donors: 5
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|