Ginsenoside Rg1 600 MHz in CD3OD NMR data.hmbc
Dataset description:
NMR data of ginsenoside Rg1 in CD3OD. The dataset contains 1D 1H 13C as well as 2D COSY, HSQC, HMBC, all acquired at 600 MHz Bruker 600 MHz spectrometer with CryoProbe (CP DCH 600S3...
Chemical Info
| InChI | InChI=1S/C42H72O15/c1-20(2)10-9-15-53-42(8,57-37-34(52)32(50)30(48)25(19-44)56-37)21-11-14-40(6)28(21)22(45)16-26-39(5)13-12-27(46)38(3,4)35(39)23(17-41(26,40)7)54-36-33(51)31(49)29(47)24(18-43)55-36/h10,21-37,43-52H,9,11-19H2,1-8H3/t21-,22+,23-,24+,25+,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36+,37-,39+,40+,41+,42-/m0/s1 |
|---|---|
| SMILES | CC(C)=CCCO[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@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]12C |
| InChI Key | OQRGKZFCNVNNHS-HHNZYBFYSA-N |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 3, 2025 |
| Metadata last updated | February 3, 2025 |
| Created | February 3, 2025 |
| Format | HTML |
| License | CC0 1.0 Legal Code |
| Id | 0e39505a-1d23-4f21-9b4d-e20595b100d5 |
| Package id | nmrxiv-d1071 |
| Resource type | HTML |
| State | active |