| SpectraBase Spectrum ID |
1HgtUulaamd |
| Name |
[(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[(1S,4R,5R)-4-[(E,3R)-3-acetoxybut-1-enyl]-3,3,5-trimethyl-cyclohexoxy]tetrahydropyran-2-yl]methyl acetate |
| Alternate Name(s) |
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(1S,4R,5R)-4-[(E,3R)-3-acetyloxybut-1-enyl]-3,3,5-trimethyl-cyclohexyl]oxy-oxan-2-yl]methyl ethanoate
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(1S,4R,5R)-4-[(E,3R)-3-acetyloxybut-1-enyl]-3,3,5-trimethylcyclohexyl]oxyoxan-2-yl]methyl acetate
Acetic acid [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(1S,4R,5R)-4-[(E,3R)-3-acetyloxybut-1-enyl]-3,3,5-trimethylcyclohexyl]oxy-2-oxanyl]methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H44O12 |
| InChI |
InChI=1S/C29H44O12/c1-15-12-22(13-29(8,9)23(15)11-10-16(2)36-18(4)31)40-28-27(39-21(7)34)26(38-20(6)33)25(37-19(5)32)24(41-28)14-35-17(3)30/h10-11,15-16,22-28H,12-14H2,1-9H3/b11-10+/t15-,16-,22+,23+,24-,25-,26+,27-,28-/m1/s1 |
| InChIKey |
XCUCUIGUKZATPI-BYIURUCSSA-N |
| Molecular Weight |
584.659 g/mol |
| SMILES |
[C@@]1([C@]([C@](OC(=O)C)([C@](O[C@]1(O[C@@]1(CC(C)(C)[C@@](\C=C\[C@](OC(=O)C)(C)[H])([C@@](C1)(C)[H])[H])[H])[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H] |
| SPLASH |
splash10-0006-9401000000-6ee84a94a7e41cd07507 |
| Source of Spectrum |
E1-43-759-4 |
| Wiley ID |
1553003 |
![[(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[(1S,4R,5R)-4-[(E,3R)-3-acetoxybut-1-enyl]-3,3,5-trimethyl-cyclohexoxy]tetrahydropyran-2-yl]methyl acetate](/api/spectrum/1HgtUulaamd/structure.png?h=300&w=458 "[(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[(1S,4R,5R)-4-[(E,3R)-3-acetoxybut-1-enyl]-3,3,5-trimethyl-cyclohexoxy]tetrahydropyran-2-yl]methyl acetate")
