Nicotiflorin, Kaem-3-Glc-6pp-Rha,...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS042310
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS042310 contains the MS2 mass spectrum of Nicotiflorin, Kaem-3-Glc-6pp-Rha, kaempferol-3-rhamnoglucoside ,...
Source: Nicotiflorin, Kaem-3-Glc-6pp-Rha, kaempferol-3-rhamnoglucoside , kaempferol-3-O-rutinoside
Chemical Info
| InChI | InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O |
| InChI Key | RTATXGUCZHCSNG-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 | 7f97c5c2-532d-41b9-b1a6-dfd703974ce0 |
| Package id | msbnk-riken_respect-ps042310 |
| Resource type | HTML |
| State | active |