Parthenolidine; N-Ac
AlkaPlorer ID: AK309430
Synonym: N-Acetylparthenolidine
IUPAC Name: N-[(4,8-dimethyl-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-12-yl)methyl]acetamide
Structure
SMILES: CC1=CCCC2(C)OC2C2OC(=O)C(CN=C(C)O)C2CC1
InChI: InChI=1S/C17H25NO4/c1-10-5-4-8-17(3)15(22-17)14-12(7-6-10)13(16(20)21-14)9-18-11(2)19/h5,12-15H,4,6-9H2,1-3H3,(H,18,19)
InChIKey: AETACSMBICRTEP-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Michelia | Magnoliaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 307.39000000000004
TPSA？: 71.42
MolLogP？: 2.798400000000001
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|