Ginsenoside Ro
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR310404
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR310404 contains the MS2 mass spectrum of Ginsenoside Ro with the InChIkey NFZYDZXHKFHPGA-UHFFFAOYSA-N.
Source: Ginsenoside Ro
Chemical Info
| InChI | InChI=1S/C48H76O19/c1-43(2)14-16-48(42(61)67-40-35(58)31(54)29(52)24(20-50)63-40)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(33(56)32(55)36(65-41)38(59)60)66-39-34(57)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-58H,9-20H2,1-7H3,(H,59,60) |
|---|---|
| SMILES | CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(O)=O)C(C)(C)C5CCC34C)C2C1)C(=O)OC1OC(CO)C(O)C(O)C1O |
| InChI Key | NFZYDZXHKFHPGA-UHFFFAOYSA-N |
| Molecular Formula | C48H76O19 |
| Exact Mass | 957.117 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 | 8c7d8acc-3ea4-45c1-8d5b-5e89636eeddc |
| Package id | msbnk-riken-pr310404 |
| Resource type | HTML |
| State | active |