Saxitoxin; N14-Me
AlkaPlorer ID: AK073855
Synonym: N'-Methylsaxitoxin
IUPAC Name: (2,6-diamino-10,10-dihydroxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-4-yl)methyl N-methylcarbamate
Structure
SMILES: CNC(=O)OCC1NC(=N)N2CCC(O)(O)C23NC(=N)NC13
InChI: InChI=1S/C11H19N7O4/c1-14-9(19)22-4-5-6-11(17-7(12)16-6)10(20,21)2-3-18(11)8(13)15-5/h5-6,20-21H,2-4H2,1H3,(H2,13,15)(H,14,19)(H3,12,16,17)
InChIKey: SDFOKPCDIGSBQL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Tetraodon | Tetraodontidae | Tetraodontiformes | Actinopteri | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 313.318
TPSA？: 165.82
MolLogP？: -3.171959999999997
Number of H-Donors: 8
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|