| SpectraBase Spectrum ID |
HicgBhvysSz |
| Name |
(1S,2R)-1,8,1',5'-tetrahydroxy-6,3'-dimethyl-2,3,6',7'-tetrahydro-1H,5'H-[2,2']binaphthalenyl-4,8'-dione |
| Appearance |
Amber yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H22O6 |
| InChI |
InChI=1S/C22H22O6/c1-9-5-11-16(25)8-13(21(27)20(11)17(26)6-9)18-10(2)7-12-14(23)3-4-15(24)19(12)22(18)28/h5-7,13-14,21,23,26-28H,3-4,8H2,1-2H3/t13-,14?,21+/m1/s1 |
| InChIKey |
XXBQCKGZTFHKKF-FBVQZCABSA-N |
| Instrument Name |
JEOL JMS-AX505 W |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030465d |
| Molecular Weight |
382.412 g/mol |
| Optical Rotation |
[a]D25 = +33.0 (c = 0.03, CHCl3) |
| Reported Formula |
C22H22O6 |
| SMILES |
O[C@]1([C@@](c2c(cc3c(C(CCC3O)=O)c2O)C)(CC(c2cc(cc(c12)O)C)=O)[H])[H] |
| SPLASH |
splash10-03di-0319000000-3a20d8939fde1e23f6ae |
| Source of Spectrum |
G4-67-1937-1 |
| Synonyms |
Octahydroeuclein |
| Wiley ID |
1881568 |
![OCTAHYDROEUCLEIN;1,8,1',5'-TETRAHYDROXY-6,3'-DIMETHYL-2,3,6',7'-TETRAHYDRO-1H,5'H-[2,2']-BINAPHTHALENYL-4,8'-DIONE](/api/spectrum/HicgBhvysSz/structure.png?h=300&w=458 "OCTAHYDROEUCLEIN;1,8,1',5'-TETRAHYDROXY-6,3'-DIMETHYL-2,3,6',7'-TETRAHYDRO-1H,5'H-[2,2']-BINAPHTHALENYL-4,8'-DIONE")
