EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:80154 - 3,4,3',4'-Tetrahydrospirilloxanthin
| Formula | C42H64O2 |
| Net Charge | 0 |
| Average Mass | 600.972 |
| Monoisotopic Mass | 600.49063 |
| SMILES | COC(C)(C)CCC/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(\C)CCCC(C)(C)OC |
| InChI | InChI=1S/C42H64O2/c1-35(23-15-25-37(3)27-17-29-39(5)31-19-33-41(7,8)43-11)21-13-14-22-36(2)24-16-26-38(4)28-18-30-40(6)32-20-34-42(9,10)44-12/h13-18,21-30H,19-20,31-34H2,1-12H3/b14-13+,23-15+,24-16+,27-17+,28-18+,35-21+,36-22+,37-25+,38-26+,39-29+,40-30+ |
| InChIKey | LCTIOHZQWXQPIB-VYCPWLLESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,4,3',4'-Tetrahydrospirilloxanthin (CHEBI:80154) is a xanthophyll (CHEBI:27325) |