Serpulanine A
AlkaPlorer ID: AK323908
Synonym: None
IUPAC Name: (2Z)-N-hydroxy-2-hydroxyimino-3-[4-(3-methylbut-2-enoxy)phenyl]propanamide
Structure
SMILES: CC(C)=CCOC1=CC=C(C/C(=N\O)C(=O)NO)C=C1
InChI: InChI=1S/C14H18N2O4/c1-10(2)7-8-20-12-5-3-11(4-6-12)9-13(15-18)14(17)16-19/h3-7,18-19H,8-9H2,1-2H3,(H,16,17)/b15-13+
InChIKey: NLPWVJBBQRDFSC-FYWRMAATSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Serpula | Serpulidae | Sabellida | Polychaeta | Annelida | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 278.308
TPSA？: 91.15
MolLogP？: 1.9097
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | Unchecked | IC50 | 7000.0 | nM | 10.1021/acs.jnatprod.7b00680 |
| None | Unchecked | Inhibition | nan | % | 10.1021/acs.jnatprod.7b00680 |