EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H32O13 |
| Net Charge | 0 |
| Average Mass | 576.551 |
| Monoisotopic Mass | 576.18429 |
| SMILES | COc1cc(C2C3=CC4=C(OCO4)C3C(OC3OC4COC(C)OC4C(O)C3O)C3COC(=O)C23)cc(OC)c1O |
| InChI | InChI=1S/C28H32O13/c1-10-35-8-17-26(39-10)22(30)23(31)28(40-17)41-24-13-7-36-27(32)19(13)18(12-6-16-25(20(12)24)38-9-37-16)11-4-14(33-2)21(29)15(5-11)34-3/h4-6,10,13,17-20,22-24,26,28-31H,7-9H2,1-3H3 |
| InChIKey | DOXHGVQIEQIIIV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-36830 (CHEBI:125357) is a alkylbenzene (CHEBI:38976) |
| LSM-36830 (CHEBI:125357) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-36830 | LINCS |