53657-29-7
Product Name:
sitoindoside II
Formula:
C53H92O7
Synonyms:
3-O-[(6′-O-oleoyl)-β-D-glucopyranosyl] sitosterol; 18:1 sitosteryl glucose
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COMPUTED DESCRIPTORS
| Molecular Weight | 841.3 g/mol |
|---|---|
| XLogP3 | 15.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 26 |
| Exact Mass | 840.68430527 g/mol |
| Monoisotopic Mass | 840.68430527 g/mol |
| Topological Polar Surface Area | 105 Ų |
| Heavy Atom Count | 60 |
| Formal Charge | 0 |
| Complexity | 1330 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 14 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |