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CHEBI:208860 - Squalestatin H5
| Formula | C23H28O11 |
| Net Charge | 0 |
| Average Mass | 480.466 |
| Monoisotopic Mass | 480.16316 |
| SMILES | C/C(=C\C(C)Cc1ccccc1)CC[C@]12O[C@H](C(=O)O)[C@@](O)(C(=O)O)[C@](C(=O)O)(O1)[C@H](O)[C@H]2O |
| InChI | InChI=1S/C23H28O11/c1-12(10-13(2)11-14-6-4-3-5-7-14)8-9-21-15(24)16(25)23(34-21,20(30)31)22(32,19(28)29)17(33-21)18(26)27/h3-7,10,13,15-17,24-25,32H,8-9,11H2,1-2H3,(H,26,27)(H,28,29)(H,30,31)/b12-10+/t13?,15-,16-,17-,21+,22-,23+/m1/s1 |
| InChIKey | KOZPGJFIEVANMC-KCGJHEDOSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Phomaspecies C2932 (ncbitaxon:86977) | - | PubMed (8071119) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Squalestatin H5 (CHEBI:208860) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| (1S,3S,4S,5R,6R,7R)-1-[(E)-3,5-dimethyl-6-phenylhex-3-enyl]-4,6,7-trihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 78439836 | ChemSpider |