| SpectraBase Spectrum ID |
IzgP9Awzti5 |
| Name |
(1S*,2R*,3R*,4S*)-2,3-Bis(hydroxymethyl)-1-[3,4-(methylenedioxy)phenyl]-4-(3,4-dimethoxyphenyl)butane-1,4-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O8 |
| InChI |
InChI=1S/C21H26O8/c1-26-16-5-3-12(7-18(16)27-2)20(24)14(9-22)15(10-23)21(25)13-4-6-17-19(8-13)29-11-28-17/h3-8,14-15,20-25H,9-11H2,1-2H3/t14-,15-,20+,21+/m0/s1 |
| InChIKey |
NQKWXDSGKFGHTM-VUEDXXQZSA-N |
| Molecular Weight |
406.431 g/mol |
| SMILES |
O[C@@]([C@]([C@](CO)([C@@](c1cc2OCOc2cc1)(O)[H])[H])(CO)[H])(c1cc(OC)c(cc1)OC)[H] |
| SPLASH |
splash10-0f79-0905000000-48431efb5e8d5eec1282 |
| Source of Spectrum |
J-60-1152-7 |
| Synonyms |
(1S,2R,3R,4S)-1-(1,3-benzodioxol-5-yl)-4-(3,4-dimethoxyphenyl)-2,3-bis(hydroxymethyl)-1,4-butanediol |
| Wiley ID |
1372086 |
![(1S*,2R*,3R*,4S*)-2,3-Bis(hydroxymethyl)-1-[3,4-(methylenedioxy)phenyl]-4-(3,4-dimethoxyphenyl)butane-1,4-diol](/api/spectrum/IzgP9Awzti5/structure.png?h=300&w=458 "(1S*,2R*,3R*,4S*)-2,3-Bis(hydroxymethyl)-1-[3,4-(methylenedioxy)phenyl]-4-(3,4-dimethoxyphenyl)butane-1,4-diol")
