Glycohyocholic acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BGC_Munich-RP007402
Dataset description:
This MassBank record with Accession MSBNK-BGC_Munich-RP007402 contains the MS2 mass spectrum of Glycohyocholic acid with the InChIkey ZQYUKJFJPJDMMR-UHFFFAOYSA-N.
Source: Glycohyocholic acid
Chemical Info
| InChI | InChI=1S/C26H43NO6/c1-14(4-7-20(29)27-13-21(30)31)16-5-6-17-22-18(9-11-25(16,17)2)26(3)10-8-15(28)12-19(26)23(32)24(22)33/h14-19,22-24,28,32-33H,4-13H2,1-3H3,(H,27,29)(H,30,31) |
|---|---|
| SMILES | CC(CCC(=O)NCC(=O)O)C1CCC2C1(CCC3C2C(C(C4C3(CCC(C4)O)C)O)O)C |
| InChI Key | ZQYUKJFJPJDMMR-UHFFFAOYSA-N |
| Molecular Formula | C26H43NO6 |
| Exact Mass | 465.309 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 4.0 International (CC BY 4.0) |
| Id | 8da4916d-29fb-4f63-a5ba-4e9e522311bf |
| Package id | msbnk-bgc_munich-rp007402 |
| Resource type | HTML |
| State | active |