1-[5-(4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl)-6-ethenyl-2-methoxy-1-methylcyclohexa-2,4-dien-1-yl]pent-4-en-1-one
AlkaPlorer ID: AK128040
Synonym: None
IUPAC Name: 1-[(1R,6R)-5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-6-ethenyl-2-methoxy-1-methylcyclohexa-2,4-dien-1-yl]pent-4-en-1-one
Structure
SMILES: C=CCCC(=O)[C@@]1(C)C(OC)=CC=C(C2=NC(C)(C)CO2)[C@H]1C=C
InChI: InChI=1S/C20H27NO3/c1-7-9-10-16(22)20(5)15(8-2)14(11-12-17(20)23-6)18-21-19(3,4)13-24-18/h7-8,11-12,15H,1-2,9-10,13H2,3-6H3/t15-,20+/m1/s1
InChIKey: KCZFETLFFMKWNZ-QRWLVFNGSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Syringa vulgaris | Syringa | Oleaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 329.4400000000001
TPSA？: 47.89
MolLogP？: 4.007800000000003
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|