Chemical structure
Glycosmisic Acid
| CID | Molecular formula | Molecular weight | Canonical smiles | Isomeric smiles | Exact mass |
|---|---|---|---|---|---|
| 38356809 | C20H20O7 | 372.4 | COC1=CC(=CC2=C1OC(C2 CO)C3=CC(=C(C=C3)O)O C)C=CC(=O)O | COC1=CC(=CC2=C1O[C@@H]([C@H]2CO)C3=CC(=C(C=C3)O)OC)/C=C/C(=O)O | 372.120903 |
SMILES: COc1cc([C@H]2Oc3c(OC)cc(/C=C/C(=O)O)cc3[C@@H]2CO)ccc1O
Synonym
| Synonym |
|---|
| (2S,3R)-glycosmisic acid |
| Glycosmisic Acid |
| ent-spicatolignan B |
| ent-glycosmisic acid |
| CHEMBL2346742 |
| (+)-DCA C |
| CHEBI:132257 |
| 443908-19-8 |
| ZINC31163558 |
| Q27225496 |
| (2E)-3-[(2S,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid |
| (E)-2alpha-(3-Methoxy-4-hydroxyphenyl)-3beta-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-propenoic acid |
Microbial origin
| Microorganism group | Scientific Name | Reference | Source |
|---|---|---|---|
| Bacteria | Sphingobium sp. |
PMID:26362985 |
NPASS |