6H-quinindoline
AlkaPlorer ID: AK036294
Synonym: ''
IUPAC Name: 6H-indolo[2,3-b]quinoline
Structure
SMILES: C1=CC=C2N=C3NC4=CC=CC=C4C3=CC2=C1
InChI: InChI=1S/C15H10N2/c1-3-7-13-10(5-1)9-12-11-6-2-4-8-14(11)17-15(12)16-13/h1-9H,(H,16,17)
InChIKey: RDFSPMPXDYGXHP-UHFFFAOYSA-N
Reference
Jusbetonin, the First Indolo[3,2-<i>b</i>]quinoline Alkaloid Glycoside, from<i>Justicia betonica</i>
PubChem CID: 67484
CAS: 243-38-9
LOTUS: LTS0184832
COCONUT: CNP0198105
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Justicia betonica | Justicia | Acanthaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 218.259
TPSA?: 28.68
MolLogP?: 3.8693000000000017
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | 786-0 | GI50 | 19.91 | nM | None |
| Homo sapiens | A498 | GI50 | 3334.26 | nM | None |
| Homo sapiens | A549 | GI50 | 245.47 | nM | None |
| Homo sapiens | ACHN | GI50 | 113.24 | nM | None |
| Homo sapiens | BT-549 | GI50 | 511.68 | nM | None |
| Homo sapiens | CAKI-1 | GI50 | 523.6 | nM | None |
| Homo sapiens | CCRF-CEM | GI50 | 196.79 | nM | None |
| Homo sapiens | COLO 205 | GI50 | 207.01 | nM | None |
| Homo sapiens | DU-145 | GI50 | 1264.74 | nM | None |
| Homo sapiens | EKVX | GI50 | 395.37 | nM | None |
| Homo sapiens | HCC 2998 | GI50 | 756.83 | nM | None |
| Homo sapiens | HCT-116 | GI50 | 31.05 | nM | None |
| Homo sapiens | HCT-15 | GI50 | 228.56 | nM | None |
| Homo sapiens | HepG2 | IC50 | 1000.0 | ug.mL-1 | 10.1007/s00044-012-0015-0 |
| Homo sapiens | HL-60 | GI50 | 191.87 | nM | None |
| Homo sapiens | HOP-92 | GI50 | 7261.06 | nM | None |
| Homo sapiens | Hs-578T | GI50 | 966.05 | nM | None |
| Homo sapiens | HT-29 | GI50 | 30.34 | nM | None |
| Homo sapiens | IGROV-1 | GI50 | 286.42 | nM | None |
| Homo sapiens | K562 | GI50 | 188.8 | nM | None |
| Homo sapiens | KB | ID50 | 0.6 | uM ml-1 | 10.1021/jm00047a008 |
| Homo sapiens | KM12 | GI50 | 348.34 | nM | None |
| Homo sapiens | LOX IMVI | GI50 | 180.3 | nM | None |
| Homo sapiens | M14 | GI50 | 535.8 | nM | None |
| Homo sapiens | Malme-3M | GI50 | 920.45 | nM | None |
| Homo sapiens | MCF7 | GI50 | 304.09 | nM | None |
| Homo sapiens | MCF7 | IC50 | 1000.0 | ug.mL-1 | 10.1007/s00044-012-0015-0 |
| Homo sapiens | MDA-MB-231 | GI50 | 1238.8 | nM | None |
| Homo sapiens | MDA-MB-435 | GI50 | 539.51 | nM | None |
| Homo sapiens | MDA-N | GI50 | 641.21 | nM | None |
| Homo sapiens | MOLT-4 | GI50 | 94.19 | nM | None |
| Homo sapiens | NCI/ADR-RES | GI50 | 1282.33 | nM | None |
| Homo sapiens | NCI-H226 | GI50 | 1023.29 | nM | None |
| Homo sapiens | NCI-H23 | GI50 | 615.18 | nM | None |
| Homo sapiens | NCI-H322M | GI50 | 244.34 | nM | None |
| Homo sapiens | NCI-H460 | GI50 | 127.94 | nM | None |
| Homo sapiens | NCI-H522 | GI50 | 82.41 | nM | None |
| Homo sapiens | OVCAR-4 | GI50 | 1028.02 | nM | None |
| Homo sapiens | OVCAR-5 | GI50 | 1686.55 | nM | None |
| Homo sapiens | OVCAR-8 | GI50 | 363.08 | nM | None |
| Homo sapiens | PC-3 | GI50 | 231.74 | nM | None |
| Homo sapiens | RPMI-8226 | GI50 | 326.59 | nM | None |
| Homo sapiens | RXF 393 | GI50 | 457.09 | nM | None |
| Homo sapiens | SF-268 | GI50 | 598.41 | nM | None |
| Homo sapiens | SF-295 | GI50 | 500.03 | nM | None |
| Homo sapiens | SF-539 | GI50 | 367.28 | nM | None |
| Homo sapiens | SK-MEL-2 | GI50 | 444.63 | nM | None |
| Homo sapiens | SK-MEL-28 | GI50 | 1312.2 | nM | None |
| Homo sapiens | SK-MEL-5 | GI50 | 698.23 | nM | None |
| Homo sapiens | SK-OV-3 | GI50 | 839.46 | nM | None |
| Homo sapiens | SN12C | GI50 | 629.51 | nM | None |
| Homo sapiens | SNB-19 | GI50 | 785.24 | nM | None |
| Homo sapiens | SNB-75 | GI50 | 2103.78 | nM | None |
| Homo sapiens | SR | GI50 | 44.06 | nM | None |
| Homo sapiens | SW-620 | GI50 | 156.31 | nM | None |
| Homo sapiens | TK-10 | GI50 | 1538.15 | nM | None |
| Homo sapiens | U-251 | GI50 | 453.94 | nM | None |
| Homo sapiens | UACC-257 | GI50 | 636.8 | nM | None |
| Homo sapiens | UACC-62 | GI50 | 632.41 | nM | None |
| Homo sapiens | UO-31 | GI50 | 597.04 | nM | None |
| None | No relevant target | pKa | 5.55 | None | 10.1021/jm00047a008 |
| None | Nucleic Acid | Delta Tm | 0.3 | degrees C | 10.1021/jm00047a008 |
