| SpectraBase Spectrum ID |
K9D7Yv8Vxnc |
| Name |
4-Hydroxy-6-methyl-3-methylidene-5-[5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl]-3A,4,7,7A-tetrahydro-1-benzofuran-2-one, 5tms |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
788.402266564 u |
| Formula |
C36H72O9Si5 |
| InChI |
InChI=1S/C36H72O9Si5/c1-24(29-25(2)22-27-30(26(3)35(37)40-27)32(29)43-48(10,11)12)20-19-21-38-36-34(45-50(16,17)18)33(44-49(13,14)15)31(42-47(7,8)9)28(41-36)23-39-46(4,5)6/h24,27-28,30-34,36H,3,19-23H2,1-2,4-18H3/t24?,27?,28-,30?,31-,32?,33+,34-,36-/m1/s1 |
| InChIKey |
GZLJKGXNZKIBCC-YWIKCALUSA-N |
| Molecular Weight |
789.388 g/mol |
| SMILES |
C1(=C(C(C2C(C1)OC(C2=C)=O)O[Si](C)(C)C)C(CCCO[C@@]1(O[C@@]([C@]([C@@]([C@]1(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(CO[Si](C)(C)C)[H])[H])C)C |
![4-Hydroxy-6-methyl-3-methylidene-5-[5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl]-3A,4,7,7A-tetrahydro-1-benzofuran-2-one, 5tms](/api/spectrum/K9D7Yv8Vxnc/structure.png?h=300&w=458 "4-Hydroxy-6-methyl-3-methylidene-5-[5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl]-3A,4,7,7A-tetrahydro-1-benzofuran-2-one, 5tms")
