5-hexadecyl-1H-pyrrole-2-carbaldehyde
AlkaPlorer ID: AK115340
Synonym: None
IUPAC Name: 5-hexadecyl-1H-pyrrole-2-carbaldehyde
Structure
SMILES: CCCCCCCCCCCCCCCCC1=CC=C(C=O)N1
InChI: InChI=1S/C21H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-17-18-21(19-23)22-20/h17-19,22H,2-16H2,1H3
InChIKey: GBHBQLGAMKIGDE-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mycale microsigmatosa | Mycale | Mycalidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 319.533
TPSA？: 32.86
MolLogP？: 6.851000000000007
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Hypoxia inducible factors; HIF-1-alpha, HIF-2-alpha | Inhibition | 50.0 | % | 10.1021/np900444m |