| SpectraBase Spectrum ID |
D3cmhQYeAwv |
| Name |
(2R,3S,4R,5R)-5-o-Allyl-3-o-benzyl-2,4-dimethoxy-5-C-phenyl pentanal 1,3-propanedithiol acetal |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
474.189851919 u |
| Formula |
C26H34O4S2 |
| InChI |
InChI=1S/C26H34O4S2/c1-4-16-29-22(21-14-9-6-10-15-21)23(27-2)24(30-19-20-12-7-5-8-13-20)25(28-3)26-31-17-11-18-32-26/h4-10,12-15,22-26H,1,11,16-19H2,2-3H3/t22-,23-,24+,25-/m1/s1 |
| InChIKey |
AIYLCJWQZRJFBB-ZKGSSEMHSA-N |
| Molecular Weight |
474.674 g/mol |
| SMILES |
C1([C@]([C@]([C@@]([C@](C2SCCCS2)(OC)[H])(OCC2=CC=CC=C2)[H])(OC)[H])(OCC=C)[H])=CC=CC=C1 |
