| SpectraBase Compound ID | CXyvD4fTFlm |
|---|---|
| InChI | InChI=1S/C46H62O9/c1-28(17-13-19-30(3)21-23-34-32(5)39(49)36(48)25-45(34,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-35-33(6)40(50)37(26-46(35,9)10)54-44-43(53)42(52)41(51)38(27-47)55-44/h11-24,36-38,41-44,47-48,51-53H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t36-,37-,38+,41+,42-,43+,44+/m1/s1 |
| InChIKey | RPOTZDWYDMWJPW-LJMZEBAFSA-N |
| Mol Weight | 759.0 g/mol |
| Molecular Formula | C46H62O9 |
| Exact Mass | 758.439384 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 92NpuG8quC3 |
|---|---|
| Name | (3S,3'S)-ASTAXANTHIN-BETA-D-GLUCOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H62O9 |
| InChI | InChI=1S/C46H62O9/c1-28(17-13-19-30(3)21-23-34-32(5)39(49)36(48)25-45(34,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-35-33(6)40(50)37(26-46(35,9)10)54-44-43(53)42(52)41(51)38(27-47)55-44/h11-24,36-38,41-44,47-48,51-53H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t36-,37-,38+,41+,42-,43+,44+/m1/s1 |
| InChIKey | RPOTZDWYDMWJPW-LJMZEBAFSA-N |
| Literature Reference Author | A.YOKOYAMA,K.ADACHI,Y.SHIZURI |
| Literature Reference Citation | J.NAT.PROD.,58,1929(1995) |
| Literature Reference DOI | 10.1021/np50126a022 |
| Molecular Weight | 758.993 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWKP574 |