5'-Thioadenosine; 3'-Epimer, disulfide
AlkaPlorer ID: AK315964
Synonym: 9-(5-Thio-β-D-xylofuranosyl)adenine disulfide
IUPAC Name: 2-(6-aminopurin-9-yl)-5-[[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyldisulfanyl]methyl]oxolane-3,4-diol
Structure
SMILES: NC1=NC=NC2=C1N=CN2C1OC(CSSCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O)C1O
InChI: InChI=1S/C20H24N10O6S2/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(35-19)1-37-38-2-8-12(32)14(34)20(36-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H2,21,23,25)(H2,22,24,26)
InChIKey: HYGRWPFOTXXMNB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Trachycladus laevispirulifer | Trachycladus | Trachycladidae | Trachycladida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 564.6100000000004
TPSA？: 238.61999999999995
MolLogP？: -1.5495999999999992
Number of H-Donors: 6
Number of H-Acceptors: 18
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|