| SpectraBase Compound ID | 6Pmf9FTrjr4 |
|---|---|
| InChI | InChI=1S/C30H46O8/c1-16-24(32)26(35-4)25(33)27(37-16)38-19-7-10-28(2)18(14-19)5-6-22-21(28)8-11-29(3)20(9-12-30(22,29)34)17-13-23(31)36-15-17/h13,16,18-22,24-27,32-34H,5-12,14-15H2,1-4H3/t16-,18+,19-,20+,21-,22+,24-,25+,26+,27-,28-,29+,30?/m0/s1 |
| InChIKey | VPUNMTHWNSJUOG-SXQZAFHHSA-N |
| Mol Weight | 534.7 g/mol |
| Molecular Formula | C30H46O8 |
| Exact Mass | 534.319268 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EB7xtczBadM |
|---|---|
| Name | Solanoside |
| Alternate Name(s) | BRN 4729620 |
| CAS Registry Number | 4356-33-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H46O8 |
| InChI | InChI=1S/C30H46O8/c1-16-24(32)26(35-4)25(33)27(37-16)38-19-7-10-28(2)18(14-19)5-6-22-21(28)8-11-29(3)20(9-12-30(22,29)34)17-13-23(31)36-15-17/h13,16,18-22,24-27,32-34H,5-12,14-15H2,1-4H3/t16-,18+,19-,20+,21-,22+,24-,25+,26+,27-,28-,29+,30?/m0/s1 |
| InChIKey | VPUNMTHWNSJUOG-SXQZAFHHSA-N |
| Molecular Weight | 534.690 g/mol |
| SMILES | O[C@]1([C@@](O[C@]([C@@]([C@@]1(OC)[H])(O)[H])(O[C@@]1(C[C@]2(CC[C@]3(C4([C@@]([C@@](C5=CC(=O)OC5)(CC4)[H])(CC[C@@]3([C@]2(CC1)C)[H])C)O)[H])[H])[H])[H])(C)[H])[H] |
| SPLASH | splash10-0pia-8947000000-97b0ea39af8bd51a63e2 |
| Source of Spectrum | J-46-1947-0 |
| Wiley ID | 1403835 |