EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C73H76O31 |
| Net Charge | 0 |
| Average Mass | 1449.380 |
| Monoisotopic Mass | 1448.43706 |
| SMILES | COC(=O)c1ccccc1C(=O)OCCOCCOC(=O)c1ccccc1C(=O)OCCOCCOC(=O)c1ccccc1C(=O)OCCOCCOC(=O)c1ccccc1C(=O)OCCOCCOC(=O)c1ccccc1C(=O)OCCOCCOC(=O)c1ccccc1C(=O)OCCOCCO |
| InChI | InChI=1S/C73H76O31/c1-87-62(75)50-14-2-3-15-51(50)63(76)95-40-29-89-30-41-97-66(79)54-18-6-7-19-55(54)67(80)99-44-33-91-34-45-101-70(83)58-22-10-11-23-59(58)71(84)103-48-37-93-38-49-104-73(86)61-25-13-12-24-60(61)72(85)102-47-36-92-35-46-100-69(82)57-21-9-8-20-56(57)68(81)98-43-32-90-31-42-96-65(78)53-17-5-4-16-52(53)64(77)94-39-28-88-27-26-74/h2-25,74H,26-49H2,1H3 |
| InChIKey | BTZZSKVEUNMWSI-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bipolaris (ncbitaxon:33194) | - | PubMed (27245469) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cochphthester F (CHEBI:227971) is a benzoate ester (CHEBI:36054) |
| IUPAC Name |
|---|
| 2-O-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxycarbonyl]benzoyl]oxyethoxy]ethoxycarbonyl]benzoyl]oxyethoxy]ethoxycarbonyl]benzoyl]oxyethoxy]ethoxycarbonyl]benzoyl]oxyethoxy]ethoxycarbonyl]benzoyl]oxyethoxy]ethyl] 1-O-methyl benzene-1,2-dicarboxylate |
| Manual Xrefs | Databases |
|---|---|
| 60596983 | ChemSpider |