Butanoic acid,3-formyl-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-1,1,6,8-tetramethyl-5-oxo-9aH-cyclopropa[3,4]benz[1,2-e]azulene-9,9a-diylester, [1aR-(1aa,1bb,4ab,7aa,7ba,8a,9b,9aa)]-


Chemical Name: Butanoic acid,3-formyl-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-1,1,6,8-tetramethyl-5-oxo-9aH-cyclopropa[3,4]benz[1,2-e]azulene-9,9a-diylester, [1aR-(1aa,1bb,4ab,7aa,7ba,8a,9b,9aa)]-
CAS Number: 100930-03-8
Product Number: AG008RDH(AGN-PC-0OQ75Z)
Synonyms:
MDL No: MFCD00036791
Molecular Formula: C28H38O8
Molecular Weight: 502.59652

Identification/Properties


Computed Properties
Molecular Weight:
502.604g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
9
Exact Mass:
502.257g/mol
Monoisotopic Mass:
502.257g/mol
Topological Polar Surface Area:
127A^2
Heavy Atom Count:
36
Formal Charge:
0
Complexity:
1060
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
8
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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