(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid
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![(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d6856c40e4f14e07a8a37dc77087624d.png "(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid")
(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid
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CAS No:
79406-10-3
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Formula:
C29H36O4
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Chemical Name:
(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid
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Synonyms:
Kaur-16-en-18-oic acid,3-[[(2E)-1-oxo-3-phenyl-2-propen-1-yl]oxy]-,(3α,4α)-;Kaur-16-en-18-oic acid,3-[(1-oxo-3-phenyl-2-propenyl)oxy]-,[3α(E),4α]-;Kaur-16-en-18-oic acid,3-[[(2E)-1-oxo-3-phenyl-2-propenyl]oxy]-,(3α,4α)-;(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid;3α-Cinnamoyloxy-ent-kaur-16-en-19-oic acid;3α-Cinnnamoyloxy-ent-kaur-16-en-19-oic acid
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CAS No:
(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid Basic Attributes
448.6
448.59
Computed Properties
Molecular Weight:448.6
XLogP3:6.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:448.26135963
Monoisotopic Mass:448.26135963
Topological Polar Surface Area:63.6
Heavy Atom Count:33
Complexity:854
Defined Atom Stereocenter Count:7
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid
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