2-[2,2-Di(1H-indol-3-yl)ethyl]aniline
AlkaPlorer ID: AK077912
Synonym: 2-[2,2-Di(1H-indol-3-yl)ethyl]benzenamine
IUPAC Name: 2-[2,2-bis(1H-indol-3-yl)ethyl]aniline
Structure
SMILES: NC1=CC=CC=C1CC(C1=CNC2=CC=CC=C12)C1=CNC2=CC=CC=C12
InChI: InChI=1S/C24H21N3/c25-22-10-4-1-7-16(22)13-19(20-14-26-23-11-5-2-8-17(20)23)21-15-27-24-12-6-3-9-18(21)24/h1-12,14-15,19,26-27H,13,25H2
InChIKey: GDGIXKWOJJMLNP-UHFFFAOYSA-N
Reference
Two New Indole Alkaloids from the Marine‐Derived Bacterium <i>Aeromonas</i> sp. CB101
PubChem CID: 236191
CAS: 6941-73-7
LOTUS: LTS0097984
NPASS: NPC113333
COCONUT: CNP0280605
{NPAtlas: NPA016480
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aeromonas sp. CB101 | Aeromonas | Aeromonadaceae | Aeromonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 351.4530000000001
TPSA？: 57.6
MolLogP？: 5.606000000000003
Number of H-Donors: 3
Number of H-Acceptors: 1
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Zika virus | Zika virus | EC50 | None | None | 10.1021/acs.jnatprod.0c00717 |