Saponarin,...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS086706
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS086706 contains the MS2 mass spectrum of Saponarin, Isovitexin-7-O-beta-D-glucopyranoside, Saponaretin-7-O-glucoside,...
Chemical Info
| InChI | InChI=1S/C27H30O15/c28-7-15-19(32)22(35)24(37)26(40-15)18-14(41-27-25(38)23(36)20(33)16(8-29)42-27)6-13-17(21(18)34)11(31)5-12(39-13)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O |
| InChI Key | HGUVPEBGCAVWID-UHFFFAOYSA-N |
| Molecular Formula | C27H30O15 |
| Exact Mass | 594.522 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | 576b79e7-b8df-4d54-8e39-76ffd37428ee |
| Package id | msbnk-riken_respect-ps086706 |
| Resource type | HTML |
| State | active |