5-(Hydroxymethyl)-1H-pyrrole-2-carboxaldehyde; N-[(4-Acetylamino)butyl]
AlkaPlorer ID: AK070443
Synonym: None
IUPAC Name: N-[4-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]butyl]acetamide
Structure
SMILES: CC(O)=NCCCCN1C(C=O)=CC=C1CO
InChI: InChI=1S/C12H18N2O3/c1-10(17)13-6-2-3-7-14-11(8-15)4-5-12(14)9-16/h4-5,8,16H,2-3,6-7,9H2,1H3,(H,13,17)
InChIKey: KWGYXNAQPYHRSW-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aegiceras corniculatum | Aegiceras | Primulaceae | Ericales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Fusarium incarnatum | Fusarium | Nectriaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 238.287
TPSA？: 74.82000000000001
MolLogP？: 1.5495
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|