197448-24-1
AlkaPlorer ID: AK016770
Synonym: '', 'Mukanadin A'
IUPAC Name: N-[(2R,3Z)-3-(2-amino-5-oxo-1H-imidazol-4-ylidene)-2-hydroxypropyl]-4-bromo-1H-pyrrole-2-carboxamide
Structure
SMILES: N=C1N=C(O)/C(=C/[C@@H](O)CNC(=O)C2=CC(Br)=CN2)N1
InChI: InChI=1S/C11H12BrN5O3/c12-5-1-7(14-3-5)9(19)15-4-6(18)2-8-10(20)17-11(13)16-8/h1-3,6,14,18H,4H2,(H,15,19)(H3,13,16,17,20)/b8-2-/t6-/m1/s1
InChIKey: DGOLYPALKIXHIE-WNGQPZJSSA-N
Reference
Novel bioactive bromopyrrole alkaloids from the Mediterranean sponge Axinella verrucosa
PubChem CID: 135467744
LOTUS: LTS0250521
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agelas nakamurai | Agelas | Agelasidae | Agelasida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 342.1529999999999
TPSA？: 133.59
MolLogP？: 0.2462699999999997
Number of H-Donors: 6
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|