Pseudojervine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR308721
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR308721 contains the MS2 mass spectrum of Pseudojervine with the InChIkey HYDDDNUKNMMWBD-UHFFFAOYSA-N.
Source: Pseudojervine
Chemical Info
| InChI | InChI=1S/C33H49NO8/c1-15-11-22-26(34-13-15)17(3)33(42-22)10-8-20-21-6-5-18-12-19(40-31-30(39)29(38)27(36)23(14-35)41-31)7-9-32(18,4)25(21)28(37)24(20)16(33)2/h5,15,17,19-23,25-27,29-31,34-36,38-39H,6-14H2,1-4H3 |
|---|---|
| SMILES | CC1C2NCC(C)CC2OC11CCC2C3CC=C4CC(CCC4(C)C3C(=O)C2=C1C)OC1OC(CO)C(O)C(O)C1O |
| InChI Key | HYDDDNUKNMMWBD-UHFFFAOYSA-N |
| Molecular Formula | C33H49NO8 |
| Exact Mass | 587.754 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 | b829d24a-60d1-412c-a0b2-9d13991981ed |
| Package id | msbnk-riken-pr308721 |
| Resource type | HTML |
| State | active |