Rhopaladin A
AlkaPlorer ID: AK001062
Synonym: None
IUPAC Name: (5-bromo-1H-indol-3-yl)-[4-hydroxy-5-[(6-hydroxyindol-3-ylidene)methyl]-1H-imidazol-2-yl]methanone
Structure
SMILES: O=C1NC(C(=O)C2=CNC3=CC=C(Br)C=C23)=NC1=CC1=CNC2=CC(O)=CC=C12
InChI: InChI=1S/C21H13BrN4O3/c22-11-1-4-16-14(6-11)15(9-24-16)19(28)20-25-18(21(29)26-20)5-10-8-23-17-7-12(27)2-3-13(10)17/h1-9,23-24,27H,(H,25,26,29)
InChIKey: FSHRNFGLSJHPCT-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Rhopalaea | Diazonidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 449.2640000000001
TPSA？: 110.34
MolLogP？: 3.8694000000000006
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|