Saxitoxin; N14,1-Dihydroxy
AlkaPlorer ID: AK056976
Synonym: N'-Hydroxyneosaxitoxin
IUPAC Name: (2-amino-5,10,10-trihydroxy-6-imino-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-4-yl)methyl N-hydroxycarbamate
Structure
SMILES: N=C1NC2C(COC(=O)NO)N(O)C(=N)N3CCC(O)(O)C23N1
InChI: InChI=1S/C10H17N7O6/c11-6-13-5-4(3-23-8(18)15-21)17(22)7(12)16-2-1-9(19,20)10(5,16)14-6/h4-5,12,19-22H,1-3H2,(H,15,18)(H3,11,13,14)
InChIKey: YBDAUZJLBCGWOB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Zosimus aeneus | Zosimus | Xanthidae | Decapoda | Malacostraca | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 331.2890000000001
TPSA？: 197.49
MolLogP？: -3.310959999999997
Number of H-Donors: 9
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|