21902-96-5
Product Name:
(22R)-5β,6β-Epoxy-3-methoxy-1-oxo-4β,22,27-trihydroxyergost-24-en-26-oic acid 26,22-lactone
Formula:
C29H42O7
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 502.6 g/mol |
---|---|
XLogP3 | 3.4 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 4 |
Exact Mass | 502.29305367 g/mol |
Monoisotopic Mass | 502.29305367 g/mol |
Topological Polar Surface Area | 106 Ų |
Heavy Atom Count | 36 |
Formal Charge | 0 |
Complexity | 1010 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 11 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |