Artocaprin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003595
Dataset description:
This MassBank record with Accession MSBNK-BS-BS003595 contains the MS2 mass spectrum of Artocaprin with the InChIkey KRGDFVQWQJIMEK-RMKNXTFCSA-N.
Source: Artocaprin
Chemical Info
| InChI | InChI=1S/C26H28O6/c1-14(2)6-9-18-21(31-5)13-22-23(24(18)29)25(30)19(10-7-15(3)4)26(32-22)17-11-8-16(27)12-20(17)28/h6-9,11-14,27-29H,10H2,1-5H3/b9-6+ |
|---|---|
| SMILES | C(C(C([H])([H])[H])(/C(=C(/C1=C(C(=C2C(=C1O[H])C(=O)C(=C(O2)C3=C(C(=C(C(=C3[H])[H])O[H])[H])O[H])C(C(=C(C([H])([H])[H])C([H])([H])[H])[H])([H])[H])[H])OC([H])([H])[H])\[H])/[H])[H])([H])([H])[H] |
| InChI Key | KRGDFVQWQJIMEK-RMKNXTFCSA-N |
| Molecular Formula | C26H28O6 |
| Exact Mass | 436.189 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-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | b23256e8-6daf-4c38-9223-bbe0c579fa84 |
| Package id | msbnk-bs-bs003595 |
| Resource type | HTML |
| State | active |