| SpectraBase Compound ID | GZh3anPLpVY |
|---|---|
| InChI | InChI=1S/C27H30O16/c28-6-14-19(32)22(35)24(37)26(42-14)40-8-15-20(33)23(36)25(38)27(43-15)41-10-3-1-9(2-4-10)11-7-39-13-5-12(29)18(31)21(34)16(13)17(11)30/h1-5,7,14-15,19-20,22-29,31-38H,6,8H2/t14-,15+,19-,20+,22+,23-,24-,25+,26-,27+/m1/s1 |
| InChIKey | YJMYKTGWWYLKCX-WWLCPLETSA-N |
| Mol Weight | 610.52 g/mol |
| Molecular Formula | C27H30O16 |
| Exact Mass | 610.153385 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1dGRK5KrH6Z |
|---|---|
| Name | Germanasim D |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 610.153384870 u |
| Formula | C27H30O16 |
| InChI | InChI=1S/C27H30O16/c28-6-14-19(32)22(35)24(37)26(42-14)40-8-15-20(33)23(36)25(38)27(43-15)41-10-3-1-9(2-4-10)11-7-39-13-5-12(29)18(31)21(34)16(13)17(11)30/h1-5,7,14-15,19-20,22-29,31-38H,6,8H2/t14-,15+,19-,20+,22+,23-,24-,25+,26-,27+/m1/s1 |
| InChIKey | YJMYKTGWWYLKCX-WWLCPLETSA-N |
| Molecular Weight | 610.521 g/mol |
| SMILES | C=12C(C(C=3C=CC(O[C@@]4([C@]([C@](O)([C@]([C@@](O4)(CO[C@]4([C@@]([C@@](O)([C@@]([C@](O4)(CO)[H])(O)[H])[H])(O)[H])[H])[H])(O)[H])[H])(O)[H])[H])=CC3)=COC2=CC(O)=C(C1O)O)=O |