| Compound Information | |
|---|---|
| ID | 635 |
| TrivialName | Ginsenoside Mc |
| Type | PPD |
| MF | C₄₁H₇₀O₁₂ |
| MolecularWeight | 754.999 |
| IUPACName | (2R,3S,4S,5R,6S)-2-[[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(2S)-2-[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-yl]oxyoxane-3,4,5-triol |
| m/z | 799.4855 |
| Retention Time | 50.49 |
| CCS | 302.62 |
| Adducts | [M−H+HCOOH]− |
| Isomeric SMILES | O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2C[C@@H](O)C4[C@@]3(C)CCC4[C@@](CC/C=C(C)/C)(O[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@@H]6[C@@H](O)[C@H](O)[C@@H](CO)O6)O5)C)C1(C)C |
| Canonical SMILES | CC(C)=CCCC(C)(OC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3CCC12C |
| Source | Other |
| Functions | antineoplastic agent, anti-diabetic, anti-obesity |
| Year | 2008 |
| References | |
| Structure |
|