2-[(1R,4aR,8S,8aR)-8-hydroxy-7-methoxy-8a-methyl-5-oxo-1,4,4a,8-tetrahydronaphthalen-1-yl]acetic acid
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![2-[(1R,4aR,8S,8aR)-8-hydroxy-7-methoxy-8a-methyl-5-oxo-1,4,4a,8-tetrahydronaphthalen-1-yl]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/12ba601a350644718858d982b9a4d982.png "2-[(1R,4aR,8S,8aR)-8-hydroxy-7-methoxy-8a-methyl-5-oxo-1,4,4a,8-tetrahydronaphthalen-1-yl]acetic acid")
2-[(1R,4aR,8S,8aR)-8-hydroxy-7-methoxy-8a-methyl-5-oxo-1,4,4a,8-tetrahydronaphthalen-1-yl]acetic acid
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CAS No:
104199-17-9
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Formula:
C14H18O5
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Chemical Name:
2-[(1R,4aR,8S,8aR)-8-hydroxy-7-methoxy-8a-methyl-5-oxo-1,4,4a,8-tetrahydronaphthalen-1-yl]acetic acid
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Synonyms:
104199-17-9;DTXSID60908851;1-Naphthaleneacetic acid, 1,4,4a,5,8,8a-hexahydro-7-methoxy-8a-methyl-5-oxo-, (1alpha,4aalpha,8abeta)-;(8-Hydroxy-7-methoxy-8a-methyl-5-oxo-1,4,4a,5,8,8a-hexahydronaphthalen-1-yl)acetic acid
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CAS No:
2-[(1R,4aR,8S,8aR)-8-hydroxy-7-methoxy-8a-methyl-5-oxo-1,4,4a,8-tetrahydronaphthalen-1-yl]acetic acid Basic Attributes
266.29 g/mol
266.11542367 g/mol
Computed Properties
Molecular Weight:266.29
XLogP3:0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:266.11542367
Monoisotopic Mass:266.11542367
Topological Polar Surface Area:83.8
Heavy Atom Count:19
Complexity:465
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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