Xestamine A; N1-Me
AlkaPlorer ID: AK317984
Synonym: Xestamine F
IUPAC Name: (Z)-N-methoxy-N-methyl-18-(1-methylpyridin-1-ium-3-yl)octadec-11-en-13-yn-1-amine
Structure
SMILES: CON(C)CCCCCCCCCC/C=C\C#CCCCCC1=C[N+](C)=CC=C1
InChI: InChI=1S/C26H43N2O/c1-27-23-20-22-26(25-27)21-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-24-28(2)29-3/h6,8,20,22-23,25H,4-5,7,9,11,13-19,21,24H2,1-3H3/q+1/b8-6-
InChIKey: WJTZDSJWHPALST-VURMDHGXSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Calyx podatypa | Calyx | Phloeodictyidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
| Ambavia gerrardii | Ambavia | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 399.64300000000014
TPSA？: 16.35
MolLogP？: 5.787600000000007
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|