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CHEBI:47595 - 2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]-L-THREO-PENTARIC ACID
| Formula | C23H20O10 |
| Net Charge | 0 |
| Average Mass | 456.403 |
| Monoisotopic Mass | 456.10565 |
| SMILES | [H]OC(=O)C([H])([H])[C@]([H])(OC(=O)/C([H])=C(\[H])c1c([H])c([H])c(O[H])c([H])c1[H])[C@@]([H])(OC(=O)/C([H])=C(\[H])c1c([H])c([H])c(O[H])c([H])c1[H])C(=O)O[H] |
| InChI | InChI=1S/C23H20O10/c24-16-7-1-14(2-8-16)5-11-20(28)32-18(13-19(26)27)22(23(30)31)33-21(29)12-6-15-3-9-17(25)10-4-15/h1-12,18,22,24-25H,13H2,(H,26,27)(H,30,31)/b11-5+,12-6+/t18-,22+/m0/s1 |
| InChIKey | VJLMRHSHSNLOGC-NOPZTHQXSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]-L-THREO-PENTARIC ACID (CHEBI:47595) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 2-deoxy-3,4-bis-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-L-threo-pentaric acid | PDBeChem |
| 2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]-L-THREO-PENTARIC ACID | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| OFF | PDBeChem |