| SpectraBase Compound ID | IUOJ9LLGGeH |
|---|---|
| InChI | InChI=1S/C48H70O7Si/c1-34(22-18-24-36(3)26-27-42-44(7,8)29-41(53-39(6)50)32-47(42,12)55-56(13,14)15)20-16-17-21-35(2)23-19-25-37(4)28-48(51)33-43-45(9,10)30-40(52-38(5)49)31-46(43,11)54-48/h16-26,33,40-41,51H,28-32H2,1-15H3/b17-16+,22-18+,23-19+,34-20+,35-21+,36-24+,37-25+/t27?,40-,41-,46-,47+,48?/m0/s1 |
| InChIKey | IFAWZVCGELEGAV-CGNJNJJLSA-N |
| Mol Weight | 787.2 g/mol |
| Molecular Formula | C48H70O7Si |
| Exact Mass | 786.489081 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | wAaIlfiC0 |
|---|---|
| Name | Fucoxanthin - 3-acetate - 5'-(trimethylsilyl) ether - methyl ketal |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C48H70O7Si |
| InChI | InChI=1S/C48H70O7Si/c1-34(22-18-24-36(3)26-27-42-44(7,8)29-41(53-39(6)50)32-47(42,12)55-56(13,14)15)20-16-17-21-35(2)23-19-25-37(4)28-48(51)33-43-45(9,10)30-40(52-38(5)49)31-46(43,11)54-48/h16-26,33,40-41,51H,28-32H2,1-15H3/b17-16+,22-18+,23-19+,34-20+,35-21+,36-24+,37-25+/t27?,40-,41-,46-,47+,48?/m0/s1 |
| InChIKey | IFAWZVCGELEGAV-CGNJNJJLSA-N |
| Molecular Weight | 787.166 g/mol |
| SMILES | OC1(O[C@@]2(C(C(C)(C)C[C@@](C2)(OC(=O)C)[H])=C1)C)C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(C=C=C1[C@@](C[C@@](OC(=O)C)(CC1(C)C)[H])(O[Si](C)(C)C)C)C)C)C)C |
| SPLASH | splash10-07cr-0190000000-00ad2133f530ac22a966 |
| Source of Spectrum | SB-46-621-2 |
| Wiley ID | 810375 |