Ammosamide B
AlkaPlorer ID: AK032924
Synonym: 6,8-Diamino-7-chloro-1-methyl-2-oxopyrrolo[4,3,2-de]quinoline-4(1H)-carboxamide
IUPAC Name: 9,11-diamino-10-chloro-2-methyl-3-oxo-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene-6-carboxamide
Structure
SMILES: CN1C(=O)C2=CC(C(N)=O)=NC3=C(N)C(Cl)=C(N)C1=C23
InChI: InChI=1S/C12H10ClN5O2/c1-18-10-5-3(12(18)20)2-4(11(16)19)17-9(5)7(14)6(13)8(10)15/h2H,14-15H2,1H3,(H2,16,19)
InChIKey: HWRGTOQGZGTNID-UHFFFAOYSA-N
Reference
Statistical optimization and anticancer activity of a red pigment isolated from Streptomyces sp. PM4
PubChem CID: 25113669
LOTUS: LTS0167810
NPASS: NPC134657
COCONUT: CNP0203019
{NPAtlas: NPA002004
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 291.69800000000004
TPSA？: 128.32999999999998
MolLogP？: 0.7415000000000005
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Escherichia coli | Escherichia coli | Activity | nan | None | 10.1021/acs.jnatprod.6b00773 |
| Homo sapiens | DU-145 | Activity | 114.59 | % | 10.1021/jm201251c |
| Homo sapiens | HCT-116 | Activity | 101.05 | % | 10.1021/jm201251c |
| Homo sapiens | HCT-116 | IC50 | 29000.0 | nM | 10.1021/acs.jnatprod.6b00773 |
| Homo sapiens | HOP-62 | Activity | 96.95 | % | 10.1021/jm201251c |
| Homo sapiens | MCF7 | Activity | 98.04 | % | 10.1021/jm201251c |
| Homo sapiens | OVCAR-3 | Activity | 115.24 | % | 10.1021/jm201251c |
| Homo sapiens | Quinone reductase 2 | IC50 | 61.0 | nM | 10.1021/jm201251c |
| Homo sapiens | Quinone reductase 2 | Imax | 90.3 | % | 10.1021/jm201251c |
| Homo sapiens | SF-539 | Activity | 88.22 | % | 10.1021/jm201251c |
| Homo sapiens | SN12C | Activity | 98.89 | % | 10.1021/jm201251c |
| Homo sapiens | UACC-62 | Activity | 100.09 | % | 10.1021/jm201251c |
| None | No relevant target | Drug metabolism | nan | None | 10.1021/acs.jnatprod.6b00773 |