Chemical structure
Mollicellin C
| CID | Molecular formula | Molecular weight | Canonical smiles | Isomeric smiles | Exact mass |
|---|---|---|---|---|---|
| 50200 | C22H20O8 | 412.4 | CC1=CC(=C(C2=C1C(=O) OC3=C(O2)C(=C(C(=C3O )OC)C(=O)C=C(C)C)C)C =O)O | CC1=CC(=C(C2=C1C(=O)OC3=C(O2)C(=C(C(=C3O)OC)C(=O)C=C(C)C)C)C=O)O | 412.115818 |
SMILES: COc1c(O)c2c(c(C)c1C(=O)C=C(C)C)Oc1c(C=O)c(O)cc(C)c1C(=O)O2
Synonym
| Synonym |
|---|
| Mollicellin C |
| UNII-26Q0EO75R3 |
| MOLLICELLINE C |
| 68436-82-8 |
| CHEBI:68802 |
| 26Q0EO75R3 |
| 11H-Dibenzo(b,e)(1,4)dioxepin-4-carboxaldehyde, 3,9-dihydroxy-8-methoxy-1,6-dimethyl-7-(3-methyl-1-oxo-2-butenyl)-11-oxo- |
| Calcium, 2-ethylhexanoate tall-oil complexes |
| CHEMBL1081161 |
| DTXSID60218563 |
| LS-60970 |
| C20046 |
| Q27137187 |
| UNII-B811E427JV component RPSLZGPKLQLZGH-UHFFFAOYSA-N |
| 3,9-dihydroxy-8-methoxy-1,6-dimethyl-7-(3-methylbut-2-enoyl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-4-carbaldehyde |
| 4,9-dihydroxy-3-methoxy-1,7-dimethyl-2-(3-methylbut-2-enoyl)-6-oxo-benzo[b][1,4]benzodioxepine-10-carbaldehyde |
| 7,14-dihydroxy-6-methoxy-4,12-dimethyl-5-(3-methylbut-2-enoyl)-10-oxo-2,9-dioxatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaene-15-carbaldehyde |
Microbial origin
| Microorganism group | Scientific Name | Reference | Source |
|---|---|---|---|
| Fungi | Chaetomium brasiliense |
PMID:19663417 |
NPASS |