| SpectraBase Spectrum ID |
6UYV3L2qupF |
| Name |
Capsanthol 3,3',6'-triacetate |
| Alternate Name(s) |
.beta.,.kappa.-Carotene-3,3',6'-triol-3,3',6'-triacetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C46H64O6 |
| InChI |
InChI=1S/C46H64O6/c1-32(20-16-22-34(3)24-26-42-36(5)28-40(50-37(6)47)29-44(42,9)10)18-14-15-19-33(2)21-17-23-35(4)25-27-43(52-39(8)49)46(13)31-41(51-38(7)48)30-45(46,11)12/h14-27,40-41,43H,28-31H2,1-13H3/b15-14+,20-16+,21-17+,26-24+,27-25+,32-18+,33-19+,34-22+,35-23+/t40-,41+,43-,46+/m1/s1 |
| InChIKey |
XOCBFEZLSTYVOA-FACZGDFVSA-N |
| Molecular Weight |
713.012 g/mol |
| SMILES |
C1(=C(C[C@](CC1(C)C)(OC(=O)C)[H])C)\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\[C@]([C@]1(C(C[C@@](C1)(OC(=O)C)[H])(C)C)C)(OC(=O)C)[H])C)C)C)C |
| SPLASH |
splash10-0a4l-4900000000-256dce401cea0cc5f864 |
| Source of Spectrum |
H-85-2355-9 |
| Wiley ID |
1524444 |
