(E)-5-[(1S,4aβ)-4β-(Acetyloxy)decahydro-2β-hydroxy-2,5,5,8aα-tetramethylnaphthalen-1-yl]-3-methyl-2-pentenoicacid
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(E)-5-[(1S,4aβ)-4β-(Acetyloxy)decahydro-2β-hydroxy-2,5,5,8aα-tetramethylnaphthalen-1-yl]-3-methyl-2-pentenoicacid
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CAS No:
70902-36-2
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Formula:
C22H36O5
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Chemical Name:
(E)-5-[(1S,4aβ)-4β-(Acetyloxy)decahydro-2β-hydroxy-2,5,5,8aα-tetramethylnaphthalen-1-yl]-3-methyl-2-pentenoicacid
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Synonyms:
Acetyllaurifolic acid
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CAS No:
(E)-5-[(1S,4aβ)-4β-(Acetyloxy)decahydro-2β-hydroxy-2,5,5,8aα-tetramethylnaphthalen-1-yl]-3-methyl-2-pentenoicacid Basic Attributes
380.51824
380.256
Computed Properties
Molecular Weight:380.5
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:380.25627424
Monoisotopic Mass:380.25627424
Topological Polar Surface Area:83.8
Heavy Atom Count:27
Complexity:622
Defined Atom Stereocenter Count:5
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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