Josamycin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81496
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML81496 contains the MS mass spectrum of Josamycin with the InChIkey XJSFLOJWULLJQS-UHFFFAOYSA-N.
Source: Josamycin
Chemical Info
| InChI | InChI=1S/C42H69NO15/c1-23(2)19-32(47)56-40-27(6)53-34(22-42(40,8)50)57-37-26(5)54-41(36(49)35(37)43(9)10)58-38-29(17-18-44)20-24(3)30(46)16-14-12-13-15-25(4)52-33(48)21-31(39(38)51-11)55-28(7)45/h12-14,16,18,23-27,29-31,34-41,46,49-50H,15,17,19-22H2,1-11H3 |
|---|---|
| SMILES | CC1CC=CC=CC(C(CC(C(C(C(CC(=O)O1)OC(=O)C)OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)OC(=O)CC(C)C)(C)O)N(C)C)O)CC=O)C)O |
| InChI Key | XJSFLOJWULLJQS-UHFFFAOYSA-N |
| Molecular Formula | C42H69NO15 |
| Exact Mass | 827.467 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 | 9a12428b-f041-4ff7-ada3-4b4896247a8b |
| Package id | msbnk-washington_state_univ-bml81496 |
| Resource type | HTML |
| State | active |