3-[(2S)-butan-2-yl]-6-(4-hydroxybenzoyl)-5-methoxypyrazin-2-ol
AlkaPlorer ID: AK098304
Synonym: None
IUPAC Name: 3-[(2S)-butan-2-yl]-6-(4-hydroxybenzoyl)-5-methoxy-1H-pyrazin-2-one
Structure
SMILES: CC[C@H](C)C1=NC(OC)=C(C(=O)C2=CC=C(O)C=C2)NC1=O
InChI: InChI=1S/C16H18N2O4/c1-4-9(2)12-15(21)17-13(16(18-12)22-3)14(20)10-5-7-11(19)8-6-10/h5-9,19H,4H2,1-3H3,(H,17,21)/t9-/m0/s1
InChIKey: RNMOAWSVAHZYEV-VIFPVBQESA-N
Reference
N-Methoxy septorinol, a substituted pyrazine from the fungus Septoria nodorum
PubChem CID: 181885
CAS: 67332-36-9
LOTUS: LTS0113456
SuperNatural Ⅲ: SN0330200-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Parastagonospora nodorum | Parastagonospora | Phaeosphaeriaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 302.33000000000004
TPSA？: 92.28
MolLogP？: 2.2286
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|