Biochanin A
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00747
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML00747 contains the MS2 mass spectrum of Biochanin A with the InChIkey WUADCCWRTIWANL-UHFFFAOYSA-N.
Source: Biochanin A
Chemical Info
| InChI | InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)O |
| InChI Key | WUADCCWRTIWANL-UHFFFAOYSA-N |
| Molecular Formula | C16H12O5 |
| Exact Mass | 284.068 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 911b61c9-4aae-4282-8ac4-8335c6f8ce04 |
| Package id | msbnk-washington_state_univ-bml00747 |
| Resource type | HTML |
| State | active |