| SpectraBase Spectrum ID |
IT7i86boHaC |
| Name |
.kappa.,.chi.-Caroten-6-one, 2,8-dihydroxy-, (2R,5R)- |
| CAS Registry Number |
122647-34-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H52O3 |
| InChI |
InChI=1S/C40H52O3/c1-28(17-13-18-30(3)21-23-35-24-22-31(4)33(6)34(35)7)15-11-12-16-29(2)19-14-20-32(5)36(41)27-38(43)40(10)26-25-37(42)39(40,8)9/h11-24,27,37,41-42H,25-26H2,1-10H3/b12-11+,17-13+,19-14+,23-21+,28-15+,29-16+,30-18+,32-20+,36-27-/t37-,40+/m1/s1 |
| InChIKey |
WEXJSYPIMPAJBD-HKRWPFQCSA-N |
| Molecular Weight |
580.853 g/mol |
| SMILES |
O\C(=C/C([C@]1(C([C@@](CC1)(O)[H])(C)C)C)=O)\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\c1c(c(C)c(cc1)C)C)C)C)C)C |
| SPLASH |
splash10-052f-9400030000-3e85227cf09088f8cdb8 |
| Source of Spectrum |
KC-1988-1381-68 |
| Synonyms |
(2R,5R)-2,8-dihydroxy-.kappa.,.chi.-caroten-6-one
(2R,5R)-2,8-dihydroxy-kappa,chi-caroten-6-one |
| Wiley ID |
1408555 |
