11-epi-mogroside V

Chemical Information
| CAS Number | 2146088-12-0 |
| PubChem CID | 162642239 |
| IUPAC Name | (2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9R,10R,11S,13R,14S,17R)-17-[(2R,5R)-5-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-6-hydroxy-6-methylheptan-2-yl]-11-hydroxy-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol |
| Molecular Formula | C60H102O29 |
| Molecular Weight | 1287.4 |
| XLogP | -3.7 |
| Topological Polar Surface Area | 477 |
| Hydrogen Bond Donor Count | 19 |
| Hydrogen Bond Acceptor Count | 29 |
| Rotatable Bond Count | 20 |
| Heavy Atom Count | 89 |
| Formal Charge | 0 |
| Complexity | 2360 |
| Property | Value |
|---|---|
| Molecular Weight | 1287.4 |
| XLogP3 | -3.7 |
| Hydrogen Bond Donor Count | 19 |
| Hydrogen Bond Acceptor Count | 29 |
| Rotatable Bond Count | 20 |
| Exact Mass | 1286.65067721 |
| Monoisotopic Mass | 1286.65067721 |
| Topological Polar Surface Area | 477 Ų |
| Heavy Atom Count | 89 |
| Formal Charge | 0 |
| Complexity | 2360 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 35 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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