5(S)-5-carboxystrictosidine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR304621
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR304621 contains the MS2 mass spectrum of 5(S)-5-carboxystrictosidine with the InChIkey LHKZIVMTXZLOTP-UHFFFAOYSA-N.
Source: 5(S)-5-carboxystrictosidine
Chemical Info
| InChI | InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36) |
|---|---|
| SMILES | COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C(C=C)C1CC1NC(CC2=C1NC1=CC=CC=C21)C(O)=O |
| InChI Key | LHKZIVMTXZLOTP-UHFFFAOYSA-N |
| Molecular Formula | C28H34N2O11 |
| Exact Mass | 574.583 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 | addd235f-6a98-49e5-aedf-40401ee86a7a |
| Package id | msbnk-riken-pr304621 |
| Resource type | HTML |
| State | active |