Aurofusarin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000704
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000704 contains the MS2 mass spectrum of Aurofusarin with the InChIkey VSWWTKVILIZDGX-UHFFFAOYSA-N.
Source: Aurofusarin
Chemical Info
| InChI | InChI=1S/C30H18O12/c1-9-5-13(31)19-15(41-9)7-11-17(25(19)35)27(37)21(29(39-3)23(11)33)22-28(38)18-12(24(34)30(22)40-4)8-16-20(26(18)36)14(32)6-10(2)42-16/h5-8,35-36H,1-4H3 |
|---|---|
| SMILES | CC1=CC(=O)C2=C(O1)C=C3C(=C2O)C(=O)C(=C(C3=O)OC)C4=C(C(=O)C5=CC6=C(C(=O)C=C(O6)C)C(=C5C4=O)O)OC |
| InChI Key | VSWWTKVILIZDGX-UHFFFAOYSA-N |
| Molecular Formula | C30H18O12 |
| Exact Mass | 570.080 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 | 1b1b771e-0c96-45bc-9c44-889f55a13b2c |
| Package id | msbnk-aafc-ac000704 |
| Resource type | HTML |
| State | active |