Oroidine
AlkaPlorer ID: AK003275
Synonym: '', 'SMR001216083', '1H-Pyrrole-2-carboxamide, N-(3-(2-amino-1H-imidazol-4-yl)-2-propenyl)-4,5-dibromo-, (E)-', 'MLS001250229', 'Oroidin'
IUPAC Name: N-[3-(2-amino-1H-imidazol-5-yl)prop-2-enyl]-4,5-dibromo-1H-pyrrole-2-carboxamide
Structure
SMILES: NC1=NC=C(C=CCNC(=O)C2=CC(Br)=C(Br)N2)N1
InChI: InChI=1S/C11H11Br2N5O/c12-7-4-8(18-9(7)13)10(19)15-3-1-2-6-5-16-11(14)17-6/h1-2,4-5,18H,3H2,(H,15,19)(H3,14,16,17)
InChIKey: QKJAXHBFQSBDAR-UHFFFAOYSA-N
Reference
New Bromopyrrole Alkaloid from the Marine Sponge <i>Agelas </i><i>w</i><i>iedenmayeri</i>
PubChem CID: 161831
CAS: 34649-22-4
LOTUS: LTS0275541
COCONUT: CNP0281754
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agelas sceptrum | Agelas | Agelasidae | Agelasida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 389.051
TPSA？: 99.58999999999996
MolLogP？: 2.2882
Number of H-Donors: 4
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|