| SpectraBase Spectrum ID |
HrUtUxrMSEt |
| Name |
(1R,2S,3S,4R)-1-(1,3-Benzodioxol-5-yl)-2,3-di(hydroxymethyl)-4-(3,4,5-trimethoxyphenyl)butan-1,4-diol |
| Alternate Name(s) |
(1R,2S,3S,4R)-1-(1,3-benzodioxol-5-yl)-2,3-bis(hydroxymethyl)-4-(3,4,5-trimethoxyphenyl)-1,4-butanediol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O9 |
| InChI |
InChI=1S/C22H28O9/c1-27-18-7-13(8-19(28-2)22(18)29-3)21(26)15(10-24)14(9-23)20(25)12-4-5-16-17(6-12)31-11-30-16/h4-8,14-15,20-21,23-26H,9-11H2,1-3H3/t14-,15-,20+,21+/m1/s1 |
| InChIKey |
QOJZCHUMEVXEEA-RPQNVMPDSA-N |
| Molecular Weight |
436.457 g/mol |
| SMILES |
O[C@]([C@@]([C@@](CO)([C@](c1cc(OC)c(c(c1)OC)OC)(O)[H])[H])(CO)[H])(c1cc2OCOc2cc1)[H] |
| SPLASH |
splash10-0fxt-0920100000-44e3b3152d8014eb3b70 |
| Source of Spectrum |
SO-0-520-12 |
| Wiley ID |
879073 |
