5-Formyl-1H-pyrrole-2-alkanenitriles; 5-Formyl-1H-pyrrole-2-docosanenitrile, 7'Z,8'-Didehydro
AlkaPlorer ID: AK298539
Synonym: 5-(21-Cyano-7-heneicosenyl)-1H-pyrrole-2-carboxaldehyde, Mycalenitrile 11
IUPAC Name: None
Structure
SMILES: N#CCCCCCCCCCCCCC/C=C/CCCCCCC1=CC=C(C=O)N1
InChI: InChI=1S/C27H44N2O/c28-24-20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-21-26-22-23-27(25-30)29-26/h7,9,22-23,25,29H,1-6,8,10-21H2/b9-7+
InChIKey: OMUFOUSKDXRYEB-VQHVLOKHSA-N
Reference
CAS: 1192613-75-4
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mycale sp. | Mycale | Mycalidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 412.6620000000002
TPSA？: 56.65
MolLogP？: 8.471280000000005
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|