114216-89-6
AlkaPlorer ID: AK025136
Synonym: None
IUPAC Name: 4-bromo-1-methyl-N-[3-[(4R)-1-methyl-2,5-dioxoimidazolidin-4-yl]propyl]pyrrole-2-carboxamide
Structure
SMILES: CN1C(=O)[C@@H](CCCNC(=O)C2=CC(Br)=CN2C)N=C1O
InChI: InChI=1S/C13H17BrN4O3/c1-17-7-8(14)6-10(17)11(19)15-5-3-4-9-12(20)18(2)13(21)16-9/h6-7,9H,3-5H2,1-2H3,(H,15,19)(H,16,21)/t9-/m1/s1
InChIKey: CIKVVARLHZDNRU-SECBINFHSA-N
Reference
Biologically active metabolites from <i>Agelas</i> <i>mauritiana</i>
PubChem CID: 162967835
LOTUS: LTS0000556
SuperNatural Ⅲ: SN0046573-01
NPASS: NPC266035
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hosta plantaginea | Hosta | Asparagaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Euphorbia salicifolia | Euphorbia | Euphorbiaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 357.208
TPSA？: 86.93
MolLogP？: 1.0521999999999998
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|