Coeligiosin A
AlkaPlorer ID: AK020302
Synonym: None
IUPAC Name: 3-methoxy-5-(1H-pyrrol-2-yl)-2-[(5-undecyl-1H-pyrrol-2-yl)-(5-undecylpyrrol-2-ylidene)methyl]-1H-pyrrole
Structure
SMILES: CCCCCCCCCCCC1=CC=C(C(=C2N=C(C3=CC=CN3)C=C2OC)C2=CC=C(CCCCCCCCCCC)N2)N1
InChI: InChI=1S/C40H60N4O/c1-4-6-8-10-12-14-16-18-20-23-32-26-28-35(42-32)39(40-38(45-3)31-37(44-40)34-25-22-30-41-34)36-29-27-33(43-36)24-21-19-17-15-13-11-9-7-5-2/h22,25-31,41-43H,4-21,23-24H2,1-3H3
InChIKey: PORBGBCZJXACJU-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces coelicolor | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 612.9470000000001
TPSA？: 68.96
MolLogP？: 11.61009999999999
Number of H-Donors: 3
Number of H-Acceptors: 2
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|