2-isobutyl-3-methoxypyrazine
AlkaPlorer ID: AK007799
Synonym: '2-Isobutyl-3-methoxypyrazine'
IUPAC Name: 2-methoxy-3-(2-methylpropyl)pyrazine
Structure
SMILES: COC1=NC=CN=C1CC(C)C
InChI: InChI=1S/C9H14N2O/c1-7(2)6-8-9(12-3)11-5-4-10-8/h4-5,7H,6H2,1-3H3
InChIKey: UXFSPRAGHGMRSQ-UHFFFAOYSA-N
Reference
Studies on the Aroma Constituents of Crude Drugs. I. On the Aroma Constituents of Ginseng Radix
PubChem CID: 32594
CAS: 142418-59-5
LOTUS: LTS0001704
SuperNatural Ⅲ: SN0382561
COCONUT: CNP0323882
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Danaus plexippus | Danaus | Nymphalidae | Lepidoptera | Insecta | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 166.224
TPSA？: 35.010000000000005
MolLogP？: 1.6837
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | Unchecked | Kd | 300.0 | nM | 10.1021/jm500325k |
| None | Unchecked | Log 1/C | 7.472 | None | 10.1021/jm001129m |