179186-48-2
Product Name:
9,12-Octadecadienoic acid, 27-[[2,3-dihydroxy-1-(hydroxymethyl)heptadecyl]amino]-27-oxoheptacosyl ester, [1S-[1R*(9Z,12Z),2R*,3S*]]- (9CI)
Formula:
C63H121NO6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 988.6 g/mol |
|---|---|
| XLogP3 | 24 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 59 |
| Exact Mass | 987.91939058 g/mol |
| Monoisotopic Mass | 987.91939058 g/mol |
| Topological Polar Surface Area | 116 Ų |
| Heavy Atom Count | 70 |
| Formal Charge | 0 |
| Complexity | 1110 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |