Tatiopterin; Tatiopterin O
AlkaPlorer ID: AK125236
Synonym: None
IUPAC Name: 2-[[2-[[5-[5-[4-[1-(2-amino-4-oxo-3H-pteridin-6-yl)ethylamino]phenyl]-2,3,4-trihydroxypentoxy]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-carboxybutanoyl]amino]butanedioic acid
Structure
SMILES: CC(NC1=CC=C(CC(O)C(O)C(O)COC2OC(COP(=O)(O)OC(CCC(=O)O)C(O)=NC(CC(=O)O)C(=O)O)C(O)C2O)C=C1)C1=CN=C2NC(=N)N=C(O)C2=N1
InChI: InChI=1S/C33H44N7O19P/c1-13(17-10-35-28-24(37-17)30(51)40-33(34)39-28)36-15-4-2-14(3-5-15)8-18(41)25(47)19(42)11-56-32-27(49)26(48)21(58-32)12-57-60(54,55)59-20(6-7-22(43)44)29(50)38-16(31(52)53)9-23(45)46/h2-5,10,13,16,18-21,25-27,32,36,41-42,47-49H,6-9,11-12H2,1H3,(H,38,50)(H,43,44)(H,45,46)(H,52,53)(H,54,55)(H3,34,35,39,40,51)
InChIKey: AGWYURZXJWVSJF-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Methanogenium | Methanomicrobiaceae | Methanomicrobiales | Methanomicrobia | Euryarchaeota | None | Archaea |
Properties Information
Molecule Weight: 873.7190000000003
TPSA？: 430.43000000000006
MolLogP？: -1.949029999999993
Number of H-Donors: 14
Number of H-Acceptors: 20
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|