Bostrycin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000503
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000503 contains the MS2 mass spectrum of Bostrycin with the InChIkey ZQNOLGRKZRDRQO-OAGGEKHMSA-N.
Source: Bostrycin
Chemical Info
| InChI | InChI=1S/C16H16O8/c1-16(23)4-5-8(14(21)15(16)22)13(20)9-6(17)3-7(24-2)12(19)10(9)11(5)18/h3,14-15,18,20-23H,4H2,1-2H3/t14-,15-,16+/m1/s1 |
|---|---|
| SMILES | C[C@@]1(CC2=C(C3=C(C(=O)C=C(C3=O)OC)C(=C2[C@H]([C@H]1O)O)O)O)O |
| InChI Key | ZQNOLGRKZRDRQO-OAGGEKHMSA-N |
| Molecular Formula | C16H16O8 |
| Exact Mass | 336.084 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 | 3fb936ba-3f56-4a26-938b-9e2d866e62c8 |
| Package id | msbnk-aafc-ac000503 |
| Resource type | HTML |
| State | active |