Salinosporamide J
AlkaPlorer ID: AK063484
Synonym: None
IUPAC Name: (1R,4R,5S)-4-(2-chloroethyl)-1-(cyclohex-2-en-1-ylmethyl)-5-methyl-6-oxa-2-azabicyclo[3.2.0]heptane-3,7-dione
Structure
SMILES: C[C@@]12OC(=O)[C@]1(CC1C=CCCC1)N=C(O)[C@@H]2CCCl
InChI: InChI=1S/C15H20ClNO3/c1-14-11(7-8-16)12(18)17-15(14,13(19)20-14)9-10-5-3-2-4-6-10/h3,5,10-11H,2,4,6-9H2,1H3,(H,17,18)/t10?,11-,14-,15-/m0/s1
InChIKey: URJGVVMJOFUXRZ-ZJINVJJNSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Salinispora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
| Salinispora tropica | Salinispora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 297.7819999999999
TPSA?: 58.89
MolLogP?: 3.002300000000001
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | RPMI-8226 | IC50 | 250.0 | nM | 10.1021/np0603471 |
| None | Unchecked | IC50 | 52.0 | nM | 10.1021/np0603471 |
