methyl 4-[(1E)-2-acetyl-4-oxotridec-1-en-1-yl]-6-propylpyridine-3-carboxylate
AlkaPlorer ID: AK254703
Synonym: None
IUPAC Name: methyl 4-(2-acetyl-4-oxotridec-1-enyl)-6-propylpyridine-3-carboxylate
Structure
SMILES: CCCCCCCCCC(=O)CC(=CC1=CC(CCC)=NC=C1C(=O)OC)C(C)=O
InChI: InChI=1S/C25H37NO4/c1-5-7-8-9-10-11-12-14-23(28)17-20(19(3)27)15-21-16-22(13-6-2)26-18-24(21)25(29)30-4/h15-16,18H,5-14,17H2,1-4H3
InChIKey: SLLJMDBREKHLTJ-UHFFFAOYSA-N
Reference
Anti-inflammatory compounds from Monascus pilosus-fermented rice
PubChem CID: 163078135
LOTUS: LTS0214436
COCONUT: CNP0381344
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Monascus pilosus | Monascus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 415.5740000000002
TPSA？: 73.33000000000001
MolLogP？: 5.893000000000006
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|