Macrocarpal E
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Macrocarpal E
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CAS No:
142628-54-4
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Formula:
C28H40O6
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Chemical Name:
Macrocarpal E
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Synonyms:
1,3-Benzenedicarboxaldehyde,2,4,6-trihydroxy-5-[(1R)-3-methyl-1-[(1R,4R,6S,8aR)-1,2,3,4,6,7,8,8a-octahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-1-naphthalenyl]butyl]-;2,4,6-Trihydroxy-5-[(1R)-3-methyl-1-[(1R,4R,6S,8aR)-1,2,3,4,6,7,8,8a-octahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-1-naphthalenyl]butyl]-1,3-benzenedicarboxaldehyde;Macrocarpal E;9′-epi-Macrocarpal Q
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CAS No:
Computed Properties
Molecular Weight:472.6
XLogP3:6.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:472.28248899
Monoisotopic Mass:472.28248899
Topological Polar Surface Area:115
Heavy Atom Count:34
Complexity:753
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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