5-bromo-1-(4-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
AlkaPlorer ID: AK595483
Synonym: None
IUPAC Name: 5-bromo-1-[4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Structure
SMILES: O=C1N=C(O)C(Br)=CN1C1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C1O
InChI: InChI=1S/C21H31BrN2O16/c22-5-1-24(21(35)23-17(5)34)18-14(33)16(7(3-26)36-18)40-20-13(32)11(30)15(8(4-27)38-20)39-19-12(31)10(29)9(28)6(2-25)37-19/h1,6-16,18-20,25-33H,2-4H2,(H,23,34,35)
InChIKey: ZRFHANMLDVJQDW-UHFFFAOYSA-N
Reference
Formation of 3′-<i>O</i>-β-Galactosyl Compounds of 5-Bromouridine by<i>Sporobolomyces singularis</i>
PubChem CID: 139583138
LOTUS: LTS0005764
COCONUT: CNP0356125.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hamamotoa singularis | Hamamotoa | Chrysozymaceae | None | Microbotryomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 647.3810000000005
TPSA？: 283.34
MolLogP？: -6.02869999999999
Number of H-Donors: 10
Number of H-Acceptors: 18
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|