EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H24O8 |
| Net Charge | 0 |
| Average Mass | 428.437 |
| Monoisotopic Mass | 428.14712 |
| SMILES | COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C(C3=O)C2CCC(=O)[C@@]2(C)C[C@H]1OC(C)=O |
| InChI | InChI=1S/C23H24O8/c1-10(24)30-13-7-22(2)12(5-6-14(22)25)16-18(13)23(3)15(9-28-4)31-21(27)11-8-29-20(17(11)23)19(16)26/h8,12-13,15H,5-7,9H2,1-4H3/t12?,13-,15-,22+,23+/m1/s1 |
| InChIKey | QDLHCMPXEPAAMD-ZGSWIPFCSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-1318 (CHEBI:91531) is a oxa-steroid (CHEBI:50917) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1318 | LINCS |