EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C63H98O8 |
| Net Charge | 0 |
| Average Mass | 983.469 |
| Monoisotopic Mass | 982.72617 |
| 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](COC(=O)CCCCCCCCCCCCCC(C)C)[C@@H](O)[C@H](O)[C@H]3O)CC2(C)C)C(C)(C)C[C@H](O)C1 |
| InChI | InChI=1S/C63H98O8/c1-45(2)28-22-20-18-16-14-13-15-17-19-21-23-35-57(65)69-44-56-58(66)59(67)60(68)61(71-56)70-53-41-51(8)55(63(11,12)43-53)39-37-49(6)34-27-32-47(4)30-25-24-29-46(3)31-26-33-48(5)36-38-54-50(7)40-52(64)42-62(54,9)10/h24-27,29-34,36-39,45,52-53,56,58-61,64,66-68H,13-23,28,35,40-44H2,1-12H3/b25-24+,31-26+,32-27+,38-36+,39-37+,46-29+,47-30+,48-33+,49-34+/t52-,53-,56-,58-,59+,60-,61-/m1/s1 |
| InChIKey | NYTQKXXVJXMQSW-DSSRBQPMSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Thermus thermophilus (ncbitaxon:274) | - | DOI (10.1016/0040-4039(95)00881-C) | |
| Thermus filiformis (ncbitaxon:276) | - | PubMed (22805960) |
| Roles Classification |
|---|
| Biological Role: | bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| thermozeaxanthin-17 (CHEBI:80207) has functional parent isoheptadecanoic acid (CHEBI:70850) |
| thermozeaxanthin-17 (CHEBI:80207) has functional parent zeaxanthin (CHEBI:27547) |
| thermozeaxanthin-17 (CHEBI:80207) has functional parent β-D-glucose (CHEBI:15903) |
| thermozeaxanthin-17 (CHEBI:80207) has role bacterial metabolite (CHEBI:76969) |
| thermozeaxanthin-17 (CHEBI:80207) is a thermozeaxanthin (CHEBI:80227) |
| IUPAC Name |
|---|
| (3R,3'R)-3-hydroxy-β,β-caroten-3'-yl 6-O-(15-methylhexadecanoyl)-β-D-glucopyranoside |
| Synonym | Source |
|---|---|
| (3R,3'R)-3'-[(6-O-15-methylhexadecanoyl-β-D-gluycopyranosyl)oxy]-β,β-caroten-3-ol | LIPID MAPS |
| Manual Xrefs | Databases |
|---|---|
| C15958 | KEGG COMPOUND |
| LMPR01070109 | LIPID MAPS |
| Citations |
|---|