8(S)-amino-2(R)-methyl-7-oxononanoic acid
AlkaPlorer ID: AK030774
Synonym: None
IUPAC Name: (2R,8S)-8-amino-2-methyl-7-oxononanoic acid
Structure
SMILES: C[C@H](N)C(=O)CCCC[C@@H](C)C(=O)O
InChI: InChI=1S/C10H19NO3/c1-7(10(13)14)5-3-4-6-9(12)8(2)11/h7-8H,3-6,11H2,1-2H3,(H,13,14)/t7-,8+/m1/s1
InChIKey: YBWPFLPQZXWNNM-SFYZADRCSA-N
Reference
PubChem CID: 177363
CAS: 181886-81-7
LOTUS: LTS0037351
NPASS: NPC485791
{NPAtlas: NPA001568
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces diastaticus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 201.266
TPSA？: 80.39
MolLogP？: 1.1837999999999995
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Blood | IC50 | 7000.0 | nM | 10.1021/np9603986 |
| Homo sapiens | Blood | IC50 | 30000.0 | nM | 10.1021/np9603986 |
| Homo sapiens | Leukotriene A4 hydrolase | IC50 | 300.0 | nM | 10.1021/np9603986 |
| Homo sapiens | Leukotriene A4 hydrolase | IC50 | 570.0 | nM | 10.1021/np9603986 |
| Oryctolagus cuniculus | Angiotensin-converting enzyme | IC50 | 100000.0 | nM | 10.1021/np9603986 |