THU
AlkaPlorer ID: AK011261
Synonym: 'H4 U', '2(1H)-Pyrimidinone, tetrahydro-4-hydroxy-1-.beta.-D-ribofuranosyl-', 'U 23284', 'TETRAHYDROURIDINE', 'Tetrahydrouridine'
IUPAC Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxy-1,3-diazinan-2-one
Structure
SMILES: O=C1NC(O)CCN1C1OC(CO)C(O)C1O
InChI: InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)
InChIKey: UCKYOOZPSJFJIZ-UHFFFAOYSA-N
Reference
PubChem CID: 270480
CAS: 18771-50-1
SuperNatural Ⅲ: SN0366693
NPASS: NPC315806
COCONUT: CNP0212556
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mentha canadensis | Mentha | Lamiaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 248.235
TPSA？: 122.49
MolLogP？: -2.840899999999999
Number of H-Donors: 5
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A498 | GI50 | 211348.9 | nM | None |
| Homo sapiens | A549 | GI50 | 250034.54 | nM | None |
| Homo sapiens | CAKI-1 | GI50 | 250034.54 | nM | None |
| Homo sapiens | CCRF-CEM | GI50 | 250034.54 | nM | None |
| Homo sapiens | COLO 205 | GI50 | 250034.54 | nM | None |
| Homo sapiens | DLD-1 | GI50 | 250034.54 | nM | None |
| Homo sapiens | DMS-114 | GI50 | 250034.54 | nM | None |
| Homo sapiens | DMS-273 | GI50 | 250034.54 | nM | None |
| Homo sapiens | EKVX | GI50 | 250034.54 | nM | None |
| Homo sapiens | HCC 2998 | GI50 | 250034.54 | nM | None |
| Homo sapiens | HCT-116 | GI50 | 140604.75 | nM | None |
| Homo sapiens | HCT-15 | GI50 | 250034.54 | nM | None |
| Homo sapiens | HL-60 | GI50 | 250034.54 | nM | None |
| Homo sapiens | HOP-18 | GI50 | 250034.54 | nM | None |
| Homo sapiens | HOP-62 | GI50 | 228034.21 | nM | None |
| Homo sapiens | HOP-92 | GI50 | 250034.54 | nM | None |
| Homo sapiens | HT-29 | GI50 | 250034.54 | nM | None |
| Homo sapiens | IGROV-1 | GI50 | 250034.54 | nM | None |
| Homo sapiens | K562 | GI50 | 250034.54 | nM | None |
| Homo sapiens | KM12 | GI50 | 250034.54 | nM | None |
| Homo sapiens | KM-20L2 | GI50 | 68706.84 | nM | None |
| Homo sapiens | LOX IMVI | GI50 | 136458.31 | nM | None |
| Homo sapiens | M19-MEL | GI50 | 212813.9 | nM | None |
| Homo sapiens | Malme-3M | GI50 | 250034.54 | nM | None |
| Homo sapiens | MCF7 | GI50 | 250034.54 | nM | None |
| Homo sapiens | MOLT-4 | GI50 | 250034.54 | nM | None |
| Homo sapiens | NCI/ADR-RES | GI50 | 250034.54 | nM | None |
| Homo sapiens | NCI-H226 | GI50 | 250034.54 | nM | None |
| Homo sapiens | NCI-H23 | GI50 | 250034.54 | nM | None |
| Homo sapiens | NCI-H322M | GI50 | 250034.54 | nM | None |
| Homo sapiens | NCI-H460 | GI50 | 250034.54 | nM | None |
| Homo sapiens | NCI-H522 | GI50 | 215774.44 | nM | None |
| Homo sapiens | OVCAR-3 | GI50 | 250034.54 | nM | None |
| Homo sapiens | OVCAR-4 | GI50 | 250034.54 | nM | None |
| Homo sapiens | OVCAR-5 | GI50 | 92044.96 | nM | None |
| Homo sapiens | OVCAR-8 | GI50 | 250034.54 | nM | None |
| Homo sapiens | RPMI-8226 | GI50 | 250034.54 | nM | None |
| Homo sapiens | RXF 393 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SF-268 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SF-295 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SF-539 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SK-MEL-2 | GI50 | 157761.13 | nM | None |
| Homo sapiens | SK-MEL-28 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SK-MEL-5 | GI50 | 66374.31 | nM | None |
| Homo sapiens | SK-OV-3 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SN12C | GI50 | 250034.54 | nM | None |
| Homo sapiens | SN12K1 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SNB-19 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SNB-75 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SNB-78 | GI50 | 250034.54 | nM | None |
| Homo sapiens | SW-620 | GI50 | 250034.54 | nM | None |
| Homo sapiens | U-251 | GI50 | 79799.47 | nM | None |
| Homo sapiens | UACC-257 | GI50 | 250034.54 | nM | None |
| Homo sapiens | UACC-62 | GI50 | 250034.54 | nM | None |
| Homo sapiens | UO-31 | GI50 | 250034.54 | nM | None |
| Homo sapiens | XF498 | GI50 | 250034.54 | nM | None |
| Mus musculus | P388 | GI50 | 250034.54 | nM | None |
| Mus musculus | P388/ADR | GI50 | 250034.54 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 0.7 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 4.2 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 6.0 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 23.7 | nM | None |