| SpectraBase Compound ID | JtJ5VGmMh2I |
|---|---|
| InChI | InChI=1S/C54H96O9/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-44(57)61-36-40-46(58)47(59)48(60)49(62-40)63-54(9,31-25-26-37(2)3)38-28-33-53(8)45(38)39(55)35-42-51(6)32-30-43(56)50(4,5)41(51)29-34-52(42,53)7/h26,38-43,45-49,55-56,58-60H,10-25,27-36H2,1-9H3/t38-,39+,40+,41-,42+,43-,45-,46+,47-,48+,49-,51-,52+,53+,54-/m0/s1 |
| InChIKey | UZNSEMYRIDSIJH-NRMCSSCOSA-N |
| Mol Weight | 889.4 g/mol |
| Molecular Formula | C54H96O9 |
| Exact Mass | 888.705435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EAS14u5pWpx |
|---|---|
| Name | GINSENOSIDE-SM1 |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H96O9 |
| InChI | InChI=1S/C54H96O9/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-44(57)61-36-40-46(58)47(59)48(60)49(62-40)63-54(9,31-25-26-37(2)3)38-28-33-53(8)45(38)39(55)35-42-51(6)32-30-43(56)50(4,5)41(51)29-34-52(42,53)7/h26,38-43,45-49,55-56,58-60H,10-25,27-36H2,1-9H3/t38-,39+,40+,41-,42+,43-,45-,46+,47-,48+,49-,51-,52+,53+,54-/m0/s1 |
| InChIKey | UZNSEMYRIDSIJH-NRMCSSCOSA-N |
| Literature Reference Author | J.LEI,X.LI,X.J.GONG,Y.N.ZHENG |
| Literature Reference Citation | MOLECULES,12,2140(2007) |
| Literature Reference DOI | 10.3390/12092140 |
| Molecular Weight | 889.351 g/mol |
| Sample ID | 57374 |
| Solvent | C5D5N |