EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C52H76O10 |
| Net Charge | 0 |
| Average Mass | 861.170 |
| Monoisotopic Mass | 860.54385 |
| SMILES | CC1=C(/C=C/C(C)=C\C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)CC2(C)C)C(C)(C)C[C@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)C1 |
| InChI | InChI=1S/C52H76O10/c1-31(19-15-21-33(3)23-25-41-35(5)27-39(29-51(41,9)10)61-49-47(57)45(55)43(53)37(7)59-49)17-13-14-18-32(2)20-16-22-34(4)24-26-42-36(6)28-40(30-52(42,11)12)62-50-48(58)46(56)44(54)38(8)60-50/h13-26,37-40,43-50,53-58H,27-30H2,1-12H3/b14-13+,19-15-,20-16+,25-23+,26-24+,31-17+,32-18+,33-21-,34-22+/t37-,38-,39+,40+,43-,44-,45+,46+,47+,48+,49-,50-/m0/s1 |
| InChIKey | BIAXCAJWQUJNIG-SFPSCPFZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Saccharolobus shibatae (ncbitaxon:2286) | - | DOI (10.1021/np960584b) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (9Z,3R,3'R)-zeaxanthin di-alpha-L-rhamnopyranoside (CHEBI:213414) is a xanthophyll (CHEBI:27325) |
| IUPAC Name |
|---|
| (2S,3R,4R,5R,6R)-2-methyl-6-[(1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13Z,15Z,17E)-3,7,12,16-tetramethyl-18-[(4R)-2,6,6-trimethyl-4-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxycyclohexen-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-yl]oxyoxane-3,4,5-triol |
| Manual Xrefs | Databases |
|---|---|
| 78438037 | ChemSpider |