Decarbamoylgonyautoxin-1
AlkaPlorer ID: AK009548
Synonym: None
IUPAC Name: [(3aS,4R,9R,10aS)-2-amino-5,10,10-trihydroxy-4-(hydroxymethyl)-6-imino-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] hydrogen sulfate
Structure
SMILES: N=C1N[C@H]2[C@H](CO)N(O)C(=N)N3C[C@@H](OS(=O)(=O)O)C(O)(O)[C@]23N1
InChI: InChI=1S/C9H16N6O8S/c10-6-12-5-3(2-16)15(19)7(11)14-1-4(23-24(20,21)22)9(17,18)8(5,14)13-6/h3-5,11,16-19H,1-2H2,(H3,10,12,13)(H,20,21,22)/t3-,4+,5-,8-/m0/s1
InChIKey: AXKNFGCPJPRVCA-WVBYAZCYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 368.3280000000001
TPSA？: 222.76
MolLogP？: -4.636159999999996
Number of H-Donors: 9
Number of H-Acceptors: 9
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|