Karakoline
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301161
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR301161 contains the MS2 mass spectrum of Karakoline with the InChIkey HKQZUYOVMYOFIT-VHNBHZRZSA-N.
Source: Karakoline
Chemical Info
| InChI | InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19?,20+,21+,22-/m1/s1 |
|---|---|
| SMILES | CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)C14 |
| InChI Key | HKQZUYOVMYOFIT-VHNBHZRZSA-N |
| Molecular Formula | C22H35NO4 |
| Exact Mass | 377.525 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 | e48f5cec-ca73-4696-8883-42708f99e075 |
| Package id | msbnk-riken-pr301161 |
| Resource type | HTML |
| State | active |