3-Phenyl-2-propen-1-yl (3β,20β)-3-(acetyloxy)-11-oxoolean-12-en-29-oate
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3-Phenyl-2-propen-1-yl (3β,20β)-3-(acetyloxy)-11-oxoolean-12-en-29-oate
structure -
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CAS No:
31581-02-9
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Formula:
C41H56O5
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Chemical Name:
3-Phenyl-2-propen-1-yl (3β,20β)-3-(acetyloxy)-11-oxoolean-12-en-29-oate
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Synonyms:
Olean-12-en-29-oic acid,3-(acetyloxy)-11-oxo-,3-phenyl-2-propen-1-yl ester,(3β,20β)-;Olean-12-en-30-oic acid,3β-hydroxy-11-oxo-,cinnamyl ester,acetate;Olean-12-en-29-oic acid,3-(acetyloxy)-11-oxo-,3-phenyl-2-propenyl ester,(3β,20β)-;3-Phenyl-2-propen-1-yl (3β,20β)-3-(acetyloxy)-11-oxoolean-12-en-29-oate;Cinoxolone;BX 311;Cinnamyl 3-O-acetylglycyrrhetate
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CAS No:
3-Phenyl-2-propen-1-yl (3β,20β)-3-(acetyloxy)-11-oxoolean-12-en-29-oate Basic Attributes
628.888
628.88
250-715-9
Computed Properties
Molecular Weight:628.9
XLogP3:9.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:628.41277488
Monoisotopic Mass:628.41277488
Topological Polar Surface Area:69.7
Heavy Atom Count:46
Complexity:1340
Defined Atom Stereocenter Count:9
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-Phenyl-2-propen-1-yl (2E)-2-methyl-2-butenoate Formula
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3-Phenyl-2-propen-1-yl (3β,20β)-3-(acetyloxy)-11-oxoolean-12-en-29-oate
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