methyl 1-((2-methyl carbamate)ethyl)-β-carboline-3-carboxylate
AlkaPlorer ID: AK024724
Synonym: None
IUPAC Name: methyl 1-[3-(methylamino)-3-oxopropyl]-9H-pyrido[3,4-b]indole-3-carboxylate
Structure
SMILES: CN=C(O)CCC1=NC(C(=O)OC)=CC2=C1NC1=CC=CC=C12
InChI: InChI=1S/C17H17N3O3/c1-18-15(21)8-7-13-16-11(9-14(19-13)17(22)23-2)10-5-3-4-6-12(10)20-16/h3-6,9,20H,7-8H2,1-2H3,(H,18,21)
InChIKey: MOQLUICCHUPWRB-UHFFFAOYSA-N
Reference
New β-carboline and indole alkaloids from Actinomycete Actinomadura sp. BCC 24717
PubChem CID: 139583351
LOTUS: LTS0238896
COCONUT: CNP0345020
{NPAtlas: NPA000930
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Actinomadura sp. | Actinomadura | Thermomonosporaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 311.341
TPSA？: 87.57
MolLogP？: 3.021600000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|