| SpectraBase Spectrum ID |
261ATlRyK5G |
| Name |
1,7-Dioxaspiro[5.5]undecan-5-one,10-hydroxy-8-[3-(hydroxymethyl)pentyl]-2-(2-hydroxypropyl)-3,9,11-trimethyl-, [6R[6.alpha.[2R*(S*),3R*],8.beta.(S*),9.beta.,10.beta.,11.alpha.]]- |
| CAS Registry Number |
104335-87-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H38O6 |
| InChI |
InChI=1S/C21H38O6/c1-6-16(11-22)7-8-17-14(4)20(25)15(5)21(26-17)19(24)9-12(2)18(27-21)10-13(3)23/h12-18,20,22-23,25H,6-11H2,1-5H3/t12-,13?,14+,15-,16?,17-,18-,20+,21+/m1/s1 |
| InChIKey |
AAHQXAHOUYHAJR-VGJPBKERSA-N |
| Molecular Weight |
386.529 g/mol |
| SMILES |
O[C@@]1([C@]([C@@]2(O[C@](CC(O)C)([C@@](CC2=O)(C)[H])[H])O[C@@]([C@@]1(C)[H])(CCC(CO)CC)[H])(C)[H])[H] |
| SPLASH |
splash10-0002-3590000000-d92b1326ebb71ffcabcb |
| Source of Spectrum |
J-51-4270-20 |
| Synonyms |
(2R,3R,6R,8R,9R,10S,11R)-8-(3-ethyl-4-hydroxybutyl)-10-hydroxy-2-(2-hydroxypropyl)-3,9,11-trimethyl-1,7-dioxaspiro[5.5]undecan-5-one |
| Wiley ID |
1362665 |
![1,7-Dioxaspiro[5.5]undecan-5-one,10-hydroxy-8-[3-(hydroxymethyl)pentyl]-2-(2-hydroxypropyl)-3,9,11-trimethyl-, [6R[6.alpha.[2R*(S*),3R*],8.beta.(S*),9.beta.,10.beta.,11.alpha.]]-](/api/spectrum/261ATlRyK5G/structure.png?h=300&w=458 "1,7-Dioxaspiro[5.5]undecan-5-one,10-hydroxy-8-[3-(hydroxymethyl)pentyl]-2-(2-hydroxypropyl)-3,9,11-trimethyl-, [6R[6.alpha.[2R*(S*),3R*],8.beta.(S*),9.beta.,10.beta.,11.alpha.]]-")
