Ergosta-5,7,22-trien-3-ol, (3b,22E)-


Chemical Name: Ergosta-5,7,22-trien-3-ol, (3b,22E)-
CAS Number: 57-87-4
Product Number: AG00IA6A(AGN-PC-0OCMXR)
Synonyms:
MDL No:
Molecular Formula: C28H44O
Molecular Weight: 396.6484

Identification/Properties


Computed Properties
Molecular Weight:
396.659g/mol
XLogP3:
7.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
4
Exact Mass:
396.339g/mol
Monoisotopic Mass:
396.339g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
712
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
8
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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