Dataset
additional
Chemical Information
| InChI | InChI=1S/C17H18O6/c1-5-22-17(19)11-8-12-13(20-3)6-7-14(21-4)16(12)15(9-11)23-10(2)18/h6-9H,5H2,1-4H3 |
|---|---|
| SMILES | CCOC(=O)c1cc(OC(=O)C)c2c(c1)c(OC)ccc2OC |
| InChI Key | PTDZJPKRIGERKK-UHFFFAOYSA-N |
| Molecular Formula | C17H18O6 |
| Exact Mass | 318.321 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/PTDZJPKRIGERKK-UHFFFAOYSA-N/additional |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/PTDZJPKRIGERKK-UHFFFAOYSA-N/additional |
| Version | |
| Author | Tim Wezeman |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2014-05-27 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | additional |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| SCHEMBL10394316 | SureChEMBL |
| 16402311 | PubChem: Thomson Pharma |
| 11313167 | PubChem |
| J1.831.244A | Nikkaji |
| ZINC000095937536 | ZINC |
| The data in this table is sourced from UniChem at EBI. | |