| SpectraBase Spectrum ID |
JKVtXOOFXXC |
| Name |
(3Z,9Z,9'Z)-3,3'-Dihydroxy-2',3',7,7',8,8'-hexadehydro-.beta.,.beta.-carotin-4,4'-dione |
| Alternate Name(s) |
3,3'-dihydroxy-2,3,7,7',8,8'-hexadehydro-beta,.beta.-carotene-4,4'-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H46O4 |
| InChI |
InChI=1S/C40H46O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-20,25,36,41-42H,26H2,1-10H3/b12-11+,17-13+,18-14+,27-15+,28-16+,29-19+,30-20+ |
| InChIKey |
BSMZEEUKRAZTGP-BXOKDNRRSA-N |
| Molecular Weight |
590.804 g/mol |
| SMILES |
OC=1C(C(=C(C#C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(C#CC=2C(CC(C(C2C)=O)O)(C)C)C)C)C)C)C(C1)(C)C)C)=O |
| SPLASH |
splash10-0006-9220040000-121d3f2dee9bb9dd612b |
| Source of Spectrum |
H-64-2468-0 |
| Wiley ID |
1409388 |
