| SpectraBase Spectrum ID |
3CITPNxZYEB |
| Name |
(3S,5R,6R,3'S)-3'-O-Trimethylsilyl-3,6-epoxy-5,6-dihydro-.beta.,.beta.-carotene-5,3'-diol |
| Alternate Name(s) |
(1R,2R,4S)-2,6,6-trimethyl-1-((1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-{(4S)-2,6,6-trimethyl-4-[(trimethylsilyl)oxy]-1-cyclohexen-1-yl}-1,3,5,7,9,11,13,15,17-octadecanonaenyl)-7-oxabicyclo[2.2.1]heptan-2-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H64O3Si |
| InChI |
InChI=1S/C43H64O3Si/c1-32(20-16-22-34(3)24-25-39-36(5)28-37(29-40(39,6)7)46-47(11,12)13)18-14-15-19-33(2)21-17-23-35(4)26-27-43-41(8,9)30-38(45-43)31-42(43,10)44/h14-27,37-38,44H,28-31H2,1-13H3/b15-14+,20-16+,21-17+,25-24+,27-26+,32-18+,33-19+,34-22+,35-23+/t37-,38-,42+,43+/m0/s1 |
| InChIKey |
WEHDVPMJABMCFF-ZLCMQPKISA-N |
| Molecular Weight |
657.067 g/mol |
| SMILES |
O[C@]1([C@]2(C(C[C@](O2)(C1)[H])(C)C)\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\C1=C(C[C@@](CC1(C)C)(O[Si](C)(C)C)[H])C)C)C)C)C)C |
| SPLASH |
splash10-0a4i-0430029000-7284c3b727f013199608 |
| Source of Spectrum |
H-76-955-1 |
| Wiley ID |
1413393 |
