| SpectraBase Spectrum ID |
2shJ3UlIzZ |
| Name |
.beta.,.kappa.-Caroten-6'-one, 3,3'-bis(acetyloxy)-7,8-didehydro-8'-hydroxy-, (3R,3'S,5'R)- |
| CAS Registry Number |
52049-47-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C44H58O6 |
| InChI |
InChI=1S/C44H58O6/c1-30(19-15-20-32(3)23-24-39-34(5)25-37(49-35(6)45)27-42(39,8)9)17-13-14-18-31(2)21-16-22-33(4)40(47)26-41(48)44(12)29-38(50-36(7)46)28-43(44,10)11/h13-22,26,37-38,47H,25,27-29H2,1-12H3/b14-13+,19-15+,21-16+,30-17+,31-18+,32-20+,33-22+,40-26-/t37-,38+,44+/m1/s1 |
| InChIKey |
FMADQYRNXRXBFX-UYIBZAIBSA-N |
| Molecular Weight |
682.942 g/mol |
| SMILES |
O\C(=C/C([C@]1(C(C[C@@](C1)(OC(=O)C)[H])(C)C)C)=O)\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(C#CC1=C(C[C@](CC1(C)C)(OC(=O)C)[H])C)C)C)C)C |
| SPLASH |
splash10-05fr-1900013000-f6dbc5bf86a9271d5b8e |
| Source of Spectrum |
KC-1988-1386-2 |
| Synonyms |
(1S,3R)-3-{(2Z,4E,6E,8E,10E,12E,14E,16E)-19-[(4R)-4-(acetyloxy)-2,6,6-trimethyl-1-cyclohexen-1-yl]-3-hydroxy-4,8,13,17-tetramethyl-2,4,6,8,10,12,14,16-nonadecaoctaen-18-ynoyl}-3,4,4-trimethylcyclopentyl acetate
Mytiloxanthin diacetate |
| Wiley ID |
1414421 |
