12-epi-fischerindole W nitrile
AlkaPlorer ID: AK069958
Synonym: None
IUPAC Name: (1S,2S,3R)-3-chloro-2-ethenyl-2,6-dimethyl-1,3,4,7-tetrahydrobenzo[c]carbazole-1-carbonitrile
Structure
SMILES: C=C[C@]1(C)[C@H](Cl)CC2=C(C3=C(NC4=CC=CC=C43)C(C)=C2)[C@@H]1C#N
InChI: InChI=1S/C21H19ClN2/c1-4-21(3)15(11-23)18-13(10-17(21)22)9-12(2)20-19(18)14-7-5-6-8-16(14)24-20/h4-9,15,17,24H,1,10H2,2-3H3/t15-,17+,21-/m0/s1
InChIKey: IJADLSDSEAXAAQ-XPIZARPCSA-N
Reference
Nitrile-containing fischerindoles from the cultured cyanobacterium Fischerella sp.
PubChem CID: 57407826
LOTUS: LTS0102836
{NPAtlas: NPA008788
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fischerella sp. | Fischerella | Hapalosiphonaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 334.8500000000001
TPSA？: 39.58
MolLogP？: 5.592500000000005
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|