2,4-Dihydro-4-(β-D-ribofuranosyl)-1,2,4(3H)-triazol-3-one
AlkaPlorer ID: AK049642
Synonym: None
IUPAC Name: 4-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-1,2,4-triazol-5-one
Structure
SMILES: OC[C@H]1O[C@@H](N2C=NN=C2O)[C@H](O)[C@@H]1O
InChI: InChI=1S/C7H11N3O5/c11-1-3-4(12)5(13)6(15-3)10-2-8-9-7(10)14/h2-6,11-13H,1H2,(H,9,14)/t3-,4-,5-,6-/m1/s1
InChIKey: ZAVXIBWBPKHKGY-KVTDHHQDSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Thermomonosporaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 217.181
TPSA？: 120.86
MolLogP？: -2.4048000000000003
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Abutilon theophrasti | Abutilon theophrasti | Activity | 15.0 | % | 10.1021/np990590i |
| Abutilon theophrasti | Abutilon theophrasti | Activity | 30.0 | % | 10.1021/np990590i |
| Abutilon theophrasti | Abutilon theophrasti | Activity | 65.0 | % | 10.1021/np990590i |
| Abutilon theophrasti | Abutilon theophrasti | Activity | 70.0 | % | 10.1021/np990590i |
| Abutilon theophrasti | Abutilon theophrasti | Activity | 80.0 | % | 10.1021/np990590i |
| Abutilon theophrasti | Abutilon theophrasti | Activity | 85.0 | % | 10.1021/np990590i |
| Alopecurus myosuroides | Alopecurus myosuroides | Activity | 0.0 | % | 10.1021/np990590i |
| Alopecurus myosuroides | Alopecurus myosuroides | Activity | 30.0 | % | 10.1021/np990590i |
| Alopecurus myosuroides | Alopecurus myosuroides | Activity | 35.0 | % | 10.1021/np990590i |
| Alopecurus myosuroides | Alopecurus myosuroides | Activity | 40.0 | % | 10.1021/np990590i |
| Alopecurus myosuroides | Alopecurus myosuroides | Activity | 70.0 | % | 10.1021/np990590i |
| Alopecurus myosuroides | Alopecurus myosuroides | Activity | 80.0 | % | 10.1021/np990590i |
| Amaranthus retroflexus | Amaranthus retroflexus | Activity | 0.0 | % | 10.1021/np990590i |
| Amaranthus retroflexus | Amaranthus retroflexus | Activity | 50.0 | % | 10.1021/np990590i |
| Amaranthus retroflexus | Amaranthus retroflexus | Activity | 70.0 | % | 10.1021/np990590i |
| Arabidopsis thaliana | Arabidopsis thaliana | Activity | nan | None | 10.1021/np990590i |
| Arabidopsis thaliana | Arabidopsis thaliana | I50 | 0.04 | ppm | 10.1021/np990590i |
| Arabidopsis thaliana | Arabidopsis thaliana | I50 | 1.8 | ppm | 10.1021/np990590i |
| Arabidopsis thaliana | Arabidopsis thaliana | I50 | 2.5 | ppm | 10.1021/np990590i |
| Arabidopsis thaliana | Arabidopsis thaliana | IC50 | 200.0 | nM | 10.1021/np990590i |
| Arabidopsis thaliana | Arabidopsis thaliana | IC50 | 8300.0 | nM | 10.1021/np990590i |
| Arabidopsis thaliana | Arabidopsis thaliana | IC50 | 11500.0 | nM | 10.1021/np990590i |
| Avena fatua | Avena fatua | Activity | 0.0 | % | 10.1021/np990590i |
| Avena fatua | Avena fatua | Activity | 50.0 | % | 10.1021/np990590i |
| Avena fatua | Avena fatua | Activity | 60.0 | % | 10.1021/np990590i |
| Avena fatua | Avena fatua | Activity | 70.0 | % | 10.1021/np990590i |
| Echinochloa crus-galli | Echinochloa crus-galli | Activity | 0.0 | % | 10.1021/np990590i |
| Echinochloa crus-galli | Echinochloa crus-galli | Activity | 70.0 | % | 10.1021/np990590i |
| Echinochloa crus-galli | Echinochloa crus-galli | Activity | 85.0 | % | 10.1021/np990590i |
| Echinochloa crus-galli | Echinochloa crus-galli | Activity | 90.0 | % | 10.1021/np990590i |
| Helianthus annuus | Helianthus annuus | Activity | 0.0 | % | 10.1021/np990590i |
| Helianthus annuus | Helianthus annuus | Activity | 10.0 | % | 10.1021/np990590i |
| Helianthus annuus | Helianthus annuus | Activity | 20.0 | % | 10.1021/np990590i |
| Helianthus annuus | Helianthus annuus | Activity | 60.0 | % | 10.1021/np990590i |
| Helianthus annuus | Helianthus annuus | Activity | 90.0 | % | 10.1021/np990590i |
| Helianthus annuus | Helianthus annuus | Activity | 95.0 | % | 10.1021/np990590i |
| Helianthus annuus | Helianthus annuus | Activity | 100.0 | % | 10.1021/np990590i |
| Ipomoea hederacea | Ipomoea hederacea | Activity | 15.0 | % | 10.1021/np990590i |
| Ipomoea hederacea | Ipomoea hederacea | Activity | 25.0 | % | 10.1021/np990590i |
| Ipomoea hederacea | Ipomoea hederacea | Activity | 40.0 | % | 10.1021/np990590i |
| Ipomoea hederacea | Ipomoea hederacea | Activity | 75.0 | % | 10.1021/np990590i |
| Ipomoea hederacea | Ipomoea hederacea | Activity | 80.0 | % | 10.1021/np990590i |
| Ipomoea hederacea | Ipomoea hederacea | Activity | 90.0 | % | 10.1021/np990590i |
| Setaria faberi | Setaria faberi | Activity | 0.0 | % | 10.1021/np990590i |
| Setaria faberi | Setaria faberi | Activity | 50.0 | % | 10.1021/np990590i |
| Setaria faberi | Setaria faberi | Activity | 60.0 | % | 10.1021/np990590i |
| Setaria faberi | Setaria faberi | Activity | 70.0 | % | 10.1021/np990590i |
| Setaria faberi | Setaria faberi | Activity | 85.0 | % | 10.1021/np990590i |
| None | Unchecked | Activity | nan | None | 10.1021/np990590i |