8-Oxoerythraline
AlkaPlorer ID: AK005385
Synonym: '', 'Dataset-S1.228'
IUPAC Name: (1S,19R)-19-methoxy-5,7-dioxa-13-azapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,15,17-pentaen-14-one
Structure
SMILES: CO[C@H]1C=CC2=CC(=O)N3CCC4=CC5=C(C=C4[C@]23C1)OCO5
InChI: InChI=1S/C18H17NO4/c1-21-13-3-2-12-7-17(20)19-5-4-11-6-15-16(23-10-22-15)8-14(11)18(12,19)9-13/h2-3,6-8,13H,4-5,9-10H2,1H3/t13-,18-/m0/s1
InChIKey: RNCIERMYMLFYAO-UGSOOPFHSA-N
Reference
Anti-HIV-1 and cytotoxicity of the alkaloids of<i>Erythrina abyssinica</i>Lam. growing in Sudan
PubChem CID: 21599256
LOTUS: LTS0232842
SuperNatural Ⅲ: SN0329914-01
NPASS: NPC231198
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Erythrina velutina | Erythrina | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 311.33700000000005
TPSA？: 48.0
MolLogP？: 1.9102
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Jurkat | IC50 | 22.0 | ug.mL-1 | 10.1016/j.bmcl.2008.10.111 |
| Homo sapiens | Jurkat | IC50 | 50.0 | ug.mL-1 | 10.1016/j.bmcl.2008.10.111 |
| Homo sapiens | Jurkat | Inhibition | 37.0 | % | 10.1016/j.bmcl.2008.10.111 |