4-bromo-N-{3-[(4Z)-2,5-dioxoimidazolidin-4-ylidene]-2-hydroxypropyl}-1H-pyrrole-2-carboxamide
AlkaPlorer ID: AK076304
Synonym: None
IUPAC Name: 4-bromo-N-[3-(2,5-dioxoimidazolidin-4-ylidene)-2-hydroxypropyl]-1H-pyrrole-2-carboxamide
Structure
SMILES: O=C(NCC(O)C=C1N=C(O)N=C1O)C1=CC(Br)=CN1
InChI: InChI=1S/C11H11BrN4O4/c12-5-1-7(13-3-5)9(18)14-4-6(17)2-8-10(19)16-11(20)15-8/h1-3,6,13,17H,4H2,(H,14,18)(H2,15,16,19,20)
InChIKey: ARVRQRRPZHARDM-UHFFFAOYSA-N
Reference
Novel bioactive bromopyrrole alkaloids from the Mediterranean sponge Axinella verrucosa
PubChem CID: 73838039
LOTUS: LTS0102186
COCONUT: CNP0129284
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Axinella verrucosa | Axinella | Axinellidae | Axinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 343.13699999999994
TPSA？: 130.3
MolLogP？: 0.6358999999999999
Number of H-Donors: 5
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|