methyl (1R,4S,5R,9S,10S,13R)-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate
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methyl (1R,4S,5R,9S,10S,13R)-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate
structure -
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CAS No:
22376-47-2
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Formula:
C21H30O3
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Chemical Name:
methyl (1R,4S,5R,9S,10S,13R)-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate
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Synonyms:
22376-47-2;ent-15-Oxo-kaur-16-en-19-oic acid methyl ester;Kaur-16-en-18-oic acid, 15-oxo-, methyl ester, (4a)-;CHEMBL597958;DTXSID40945027;Methyl 15-oxokaur-16-en-18-oate;methyl dimethyl-methylene-oxo-[?]carboxylate;15-Oxokaur-16-en-18-oic acid methyl ester
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CAS No:
methyl (1R,4S,5R,9S,10S,13R)-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate Basic Attributes
330.5 g/mol
330.21949481 g/mol
Computed Properties
Molecular Weight:330.5
XLogP3:4.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:330.21949481
Monoisotopic Mass:330.21949481
Topological Polar Surface Area:43.4
Heavy Atom Count:24
Complexity:623
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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