CID 6439795
AlkaPlorer ID: AK475227
Synonym: None
IUPAC Name: 3-[(E)-[3-methoxy-5-(1H-pyrrol-2-yl)pyrrol-2-ylidene]methyl]-1,4-dimethyl-4,5,6,7-tetrahydro-2H-isoindole
Structure
SMILES: COC1=C/C(=C2\C=CC=N2)N/C1=C/C1=C2C(=C(C)N1)CCCC2C
InChI: InChI=1S/C20H23N3O/c1-12-6-4-7-14-13(2)22-18(20(12)14)10-17-19(24-3)11-16(23-17)15-8-5-9-21-15/h5,8-12,22-23H,4,6-7H2,1-3H3/b16-15-,17-10+
InChIKey: OCCNYGGVVVZDTB-HZYVTAJCSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudoalteromonas denitrificans | Pseudoalteromonas | Pseudoalteromonadaceae | Alteromonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 321.4240000000001
TPSA？: 53.17
MolLogP？: 2.677220000000001
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|