Ginsenoside F1
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR304357
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR304357 contains the MS2 mass spectrum of Ginsenoside F1 with the InChIkey XNGXWSFSJIQMNC-FIYORUNESA-N.
Source: Ginsenoside F1
Chemical Info
InChI | InChI=1S/C36H62O9/c1-19(2)10-9-13-36(8,45-31-29(43)28(42)27(41)23(18-37)44-31)20-11-15-34(6)26(20)21(38)16-24-33(5)14-12-25(40)32(3,4)30(33)22(39)17-35(24,34)7/h10,20-31,37-43H,9,11-18H2,1-8H3/t20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,30-,31-,33+,34+,35+,36-/m0/s1 |
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SMILES | CC(C)=CCC[C@](C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3[C@@H](O)C[C@@]21C |
InChI Key | XNGXWSFSJIQMNC-FIYORUNESA-N |
Molecular Formula | C36H62O9 |
Exact Mass | 638.883 g/mol |
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Additional Information
Field | Value |
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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 | 23dd3231-6eab-4655-8c24-360897c55410 |
Package id | msbnk-riken-pr304357 |
Resource type | HTML |
State | active |