EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C31H32O10 |
| Net Charge | 0 |
| Average Mass | 564.587 |
| Monoisotopic Mass | 564.19955 |
| SMILES | COc1cc(OC)c2c(O)c3c(c(-c4c(O)cc(OC)c5c(O)c6c(cc45)[C@H](O)[C@H](C)OC6)c2c1)[C@H](O)[C@H](C)OC3 |
| InChI | InChI=1S/C31H32O10/c1-12-28(33)15-8-17-23(20(32)9-22(39-5)25(17)30(35)18(15)10-40-12)26-16-6-14(37-3)7-21(38-4)24(16)31(36)19-11-41-13(2)29(34)27(19)26/h6-9,12-13,28-29,32-36H,10-11H2,1-5H3/t12-,13-,28+,29+/m0/s1 |
| InChIKey | SCANZLMQCZBPCM-SAAODOGCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Cordyceps (ncbitaxon:45234) | - | PubMed (17887724) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3S,4S)-6-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromen-5-yl]-9-methoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,7,10-triol (CHEBI:205232) is a lignan (CHEBI:25036) |
| IUPAC Name |
|---|
| (3S,4S)-6-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromen-5-yl]-9-methoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,7,10-triol |
| Manual Xrefs | Databases |
|---|---|
| 23310875 | ChemSpider |