7-({3-bromo-2-[(2,3-dibromo-4,5-dihydroxyphenyl)methyl]-4,5-dihydroxyphenyl}methyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
AlkaPlorer ID: AK001239
Synonym: None
IUPAC Name: 7-[[3-bromo-2-[(2,3-dibromo-4,5-dihydroxyphenyl)methyl]-4,5-dihydroxyphenyl]methyl]-3H-purine-2,6-dione
Structure
SMILES: OC1=NC(O)=C2C(=N1)N=CN2CC1=CC(O)=C(O)C(Br)=C1CC1=CC(O)=C(O)C(Br)=C1Br
InChI: InChI=1S/C19H13Br3N4O6/c20-11-6(2-9(27)16(30)13(11)22)1-8-7(3-10(28)15(29)12(8)21)4-26-5-23-17-14(26)18(31)25-19(32)24-17/h2-3,5,27-30H,1,4H2,(H2,24,25,31,32)
InChIKey: UWKQGGGAGXOVAC-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rhodomela confervoides | Rhodomela | Rhodomelaceae | Ceramiales | Florideophyceae | Rhodophyta | None | Eukaryota |
Properties Information
Molecule Weight: 633.0470000000001
TPSA？: 164.98
MolLogP？: 3.986500000000004
Number of H-Donors: 6
Number of H-Acceptors: 10
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|