(Z)-7-[(1S,3R,4R,5S)-3-[(E,3S)-3-hydroxyoct-1-enyl]-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]hept-5-enoic acid


Chemical Name: (Z)-7-[(1S,3R,4R,5S)-3-[(E,3S)-3-hydroxyoct-1-enyl]-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
CAS Number: 71111-01-8
Product Number: AG00FBB9(AGN-PC-00URYB)
Synonyms:
MDL No: MFCD00135924
Molecular Formula: C24H40O3
Molecular Weight: 376.5726

Identification/Properties


Computed Properties
Molecular Weight:
376.581g/mol
XLogP3:
6.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
12
Exact Mass:
376.298g/mol
Monoisotopic Mass:
376.298g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
520
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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