Wikidata entity: Q106040898
C₁₃H₂₄N₄O₃S (P274)
Quantities
| P2067 | mass | 316.156911628 |
| P233 | canonical SMILES | String | CC(C)(C)NCC(COC1=NSN=C1N2CCOCC2)O | ??? |
| P31 | instance of | ... | Q59199015 (group of stereoisomers) | group of stereoisomers |
| P279 | subclass of | ... | Q11173 (chemical compound) | chemical compound |
| P231 | CAS Registry Number | 29023-48-1 |
| P683 | ChEBI ID | 39465 |
| P3117 | DSSTox substance ID | DTXSID20860380 |
| P2057 | Human Metabolome Database ID | HMDB0014517 |
| P234 | InChI | InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3 |
| P235 | InChIKey | BLJRIMJGRPQVNF-UHFFFAOYSA-N |
| P6689 | MassBank accession ID | MSBNK-Eawag-EQ321002 |
| P6689 | MassBank accession ID | MSBNK-Eawag-EQ321003 |
| P6689 | MassBank accession ID | MSBNK-Eawag-EQ321004 |
| P6689 | MassBank accession ID | MSBNK-Eawag-EQ321005 |
| P6689 | MassBank accession ID | MSBNK-Eawag-EQ321006 |
| P6689 | MassBank accession ID | MSBNK-Eawag-EQ321007 |
| P6689 | MassBank accession ID | MSBNK-Eawag-EQ321008 |
| P6689 | MassBank accession ID | MSBNK-Eawag-EQ321009 |
| P9405 | NMRShiftDB structure ID | 20180414 |
| P662 | PubChem CID | 5478 |
| P2877 | SureChEMBL ID | 1587691 |
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