N-[(1R)-1-{4-[(1E,3E)-6-[(1R,2S)-2-hydroxy-2-methyl-5-oxocyclohexyl]-5-oxohexa-1,3-dien-1-yl]-1,3-thiazol-2-yl}ethyl]acetamide
AlkaPlorer ID: AK526080
Synonym: None
IUPAC Name: N-[(1R)-1-[4-[(1E,3E)-6-[(1R,2S)-2-hydroxy-2-methyl-5-oxocyclohexyl]-5-oxohexa-1,3-dienyl]-1,3-thiazol-2-yl]ethyl]acetamide
Structure
SMILES: CC(O)=N[C@H](C)C1=NC(/C=C/C=C/C(=O)C[C@H]2CC(=O)CC[C@]2(C)O)=CS1
InChI: InChI=1S/C20H26N2O4S/c1-13(21-14(2)23)19-22-16(12-27-19)6-4-5-7-17(24)10-15-11-18(25)8-9-20(15,3)26/h4-7,12-13,15,26H,8-11H2,1-3H3,(H,21,23)/b6-4+,7-5+/t13-,15+,20+/m1/s1
InChIKey: SQWIUXIQFDGCBG-RPPGOJCVSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces atroolivaceus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 390.50500000000017
TPSA？: 99.85
MolLogP？: 3.829300000000004
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|