250782-32-2
AlkaPlorer ID: AK016785
Synonym: '', 'Mukanadin B'
IUPAC Name: 4-bromo-N-[3-(2,5-dioxoimidazolidin-4-ylidene)propyl]-1H-pyrrole-2-carboxamide
Structure
SMILES: O=C(NCCC=C1N=C(O)N=C1O)C1=CC(Br)=CN1
InChI: InChI=1S/C11H11BrN4O3/c12-6-4-8(14-5-6)9(17)13-3-1-2-7-10(18)16-11(19)15-7/h2,4-5,14H,1,3H2,(H,13,17)(H2,15,16,18,19)
InChIKey: YQZITYXENRLMTK-UHFFFAOYSA-N
Reference
Novel bioactive bromopyrrole alkaloids from the Mediterranean sponge Axinella verrucosa
PubChem CID: 85179261
CAS: 250782-32-2
LOTUS: LTS0212082
COCONUT: CNP0301126
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agelas nakamurai | Agelas | Agelasidae | Agelasida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 327.13800000000003
TPSA？: 110.07
MolLogP？: 1.6651
Number of H-Donors: 4
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|