| SpectraBase Spectrum ID |
CLKzt1UiiAx |
| Name |
(2Z,4E,6E,8E,10E,12E,14E,16E)-3-hydroxy-19-[(4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-4,8,13,17-tetramethyl-1-nonadeca-2,4,6,8,10,12,14,16-octaen-18-ynone |
| CAS Registry Number |
50906-61-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H54O4 |
| InChI |
InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-35-32(5)23-33(41)25-38(35,6)7)15-11-12-16-29(2)19-14-20-31(4)36(43)24-37(44)40(10)27-34(42)26-39(40,8)9/h11-20,24,33-34,41-43H,23,25-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+,36-24-/t33-,34+,40+/m1/s1 |
| InChIKey |
WSLGBPCJDUQFND-BBPSKTQQSA-N |
| Molecular Weight |
598.868 g/mol |
| SMILES |
O[C@]1(CC([C@](C(\C=C/(\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(C#CC2=C(C[C@](CC2(C)C)(O)[H])C)C)C)C)C)O)=O)(C1)C)(C)C)[H] |
| SPLASH |
splash10-052f-9800010000-fc8356886c080607acd8 |
| Source of Spectrum |
KC-1988-1386-1 |
| Synonyms |
(2Z,4E,6E,8E,10E,12E,14E,16E)-3-hydroxy-19-[(4R)-4-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl]-1-[(1R,4S)-4-hydroxy-1,2,2-trimethyl-cyclopentyl]-4,8,13,17-tetramethyl-nonadeca-2,4,6,8,10,12,14,16-octaen-18-yn-1-one
(2Z,4E,6E,8E,10E,12E,14E,16E)-4,8,13,17-tetramethyl-3-oxidanyl-19-[(4R)-2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl]-1-[(1R,4S)-1,2,2-trimethyl-4-oxidanyl-cyclopentyl]nonadeca-2,4,6,8,10,12,14,16-octaen-18-yn-1-one
Mytiloxanthin |
| Wiley ID |
1410017 |
![(2Z,4E,6E,8E,10E,12E,14E,16E)-3-hydroxy-19-[(4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-4,8,13,17-tetramethyl-1-nonadeca-2,4,6,8,10,12,14,16-octaen-18-ynone](/api/spectrum/CLKzt1UiiAx/structure.png?h=300&w=458 "(2Z,4E,6E,8E,10E,12E,14E,16E)-3-hydroxy-19-[(4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-4,8,13,17-tetramethyl-1-nonadeca-2,4,6,8,10,12,14,16-octaen-18-ynone")
