| C44H32O27 | 992.7 g/mol |
| Name | Methyl–ellagic–pentose |
|---|---|
| Alternative name | Ellagic acid 4-O-xylopyranoside |
| Formula | C44H32O27 |
| Formula Weight | 992.70 g/mol |
| Molecular Weight | 992.70 g/mol |
| Monoisotopic Mass | 992.113000 g/mol |
| InChI Key | DVBQHEGQMJLCBQ-VFBNLJSFSA-N |
| IUPAC | [(8R,9S,27R,29S,30R,36R,37S,38S)-2,3,14,15,16,19,20,21,36,37-decahydroxy-6,11,24,32,35-pentaoxo-36-(2-oxopropyl)-7,10,25,28,31,40-hexaoxaoctacyclo[35.2.1.05,39.08,27.09,30.012,17.018,23.033,38]tetraconta-1(39),2,4,12,14,16,18,20,22,33-decaen-29-yl] 3,4,5-trihydroxybenzoate |
| InChI | InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+ |
| SMILES | OC1=CC=C(\C=C\C2=CC(O)=CC(O)=C2)C=C1 |
| Food | Berry, |
|---|---|
| Food Source | Strawberry, |
| Family | Phenolic |
| Class | Tannin |
| Subclass Group | Hydrolyzable tannin |
| Subclass | Ellagitannin |
| Metabolite | Valerolactone metabolite |