| SpectraBase Compound ID | EENYCjZXAKT |
|---|---|
| InChI | InChI=1S/C47H68O7Si/c1-33(21-17-23-35(3)25-26-43-45(9,10)30-40(52-38(6)49)31-46(43,11)54-55(12,13)14)19-15-16-20-34(2)22-18-24-36(4)28-47(50)32-41-42(53-47)27-39(51-37(5)48)29-44(41,7)8/h15-25,32,39-40,42,50H,27-31H2,1-14H3/b16-15+,21-17+,22-18+,33-19+,34-20+,35-23+,36-24+/t26?,39-,40?,42?,46?,47?/m1/s1 |
| InChIKey | NRBDRSMPAWOUDM-RUGSZLLYSA-N |
| Mol Weight | 773.1 g/mol |
| Molecular Formula | C47H68O7Si |
| Exact Mass | 772.473431 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1MM98Jxnhrj |
|---|---|
| Name | Fucoxanthin - 3-acetate - 5'-(trimethylsilyl) ether - hemiketal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C47H68O7Si |
| InChI | InChI=1S/C47H68O7Si/c1-33(21-17-23-35(3)25-26-43-45(9,10)30-40(52-38(6)49)31-46(43,11)54-55(12,13)14)19-15-16-20-34(2)22-18-24-36(4)28-47(50)32-41-42(53-47)27-39(51-37(5)48)29-44(41,7)8/h15-25,32,39-40,42,50H,27-31H2,1-14H3/b16-15+,21-17+,22-18+,33-19+,34-20+,35-23+,36-24+/t26?,39-,40?,42?,46?,47?/m1/s1 |
| InChIKey | NRBDRSMPAWOUDM-RUGSZLLYSA-N |
| Molecular Weight | 773.139 g/mol |
| SMILES | OC1(C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(C=C=C2C(CC(OC(=O)C)CC2(C)C)(O[Si](C)(C)C)C)C)C)C)C)OC2C[C@@](OC(=O)C)(CC(C2=C1)(C)C)[H] |
| SPLASH | splash10-0cdi-0890000100-e13cd0d1ea11a741302c |
| Source of Spectrum | SB-46-621-2 |
| Wiley ID | 810374 |