| SpectraBase Spectrum ID |
LSucvdo4stu |
| Name |
(2R,3S)-2,3-Diacetoxy-.beta.,.beta.-caroten-4-one |
| Alternate Name(s) |
(1R,6S)-6-(acetyloxy)-2,2,4-trimethyl-5-oxo-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5,7,9,11,13,15,17-octadecanonaenyl]-3-cyclohexen-1-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C44H58O5 |
| InChI |
InChI=1S/C44H58O5/c1-30(20-15-22-32(3)25-27-38-34(5)24-17-29-43(38,9)10)18-13-14-19-31(2)21-16-23-33(4)26-28-39-35(6)40(47)41(48-36(7)45)42(44(39,11)12)49-37(8)46/h13-16,18-23,25-28,41-42H,17,24,29H2,1-12H3/b14-13+,20-15+,21-16+,27-25+,28-26+,30-18+,31-19+,32-22+,33-23+/t41-,42+/m1/s1 |
| InChIKey |
RLDPLBASSMNCHG-HKTJOMBSSA-N |
| Molecular Weight |
666.943 g/mol |
| SMILES |
C1(=C(C(=O)[C@]([C@@](C1(C)C)(OC(=O)C)[H])(OC(=O)C)[H])C)\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\C1=C(CCCC1(C)C)C)C)C)C)C |
| SPLASH |
splash10-0udi-0090021000-45cc20446c6a47b00c24 |
| Source of Spectrum |
H-62-2557-0 |
| Wiley ID |
1413796 |
