Kaempferol-3-O-rutinoside
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR306651
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR306651 contains the MS2 mass spectrum of Kaempferol-3-O-rutinoside with the InChIkey RTATXGUCZHCSNG-UHFFFAOYSA-N.
Source: 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 |
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SMILES | CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O |
InChI Key | RTATXGUCZHCSNG-UHFFFAOYSA-N |
Molecular Formula | C27H30O15 |
Exact Mass | 594.522 g/mol |
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Additional Information
Field | Value |
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Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
Id | c207f5c2-f8a7-4733-8956-bc0150fbd2ea |
Package id | msbnk-riken-pr306651 |
Resource type | HTML |
State | active |