(4bS,8aR)-2,4b,8,8-tetramethyl-7,10-dioxo-5,6,8a,9-tetrahydrophenanthrene-3-carboxylic acid
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(4bS,8aR)-2,4b,8,8-tetramethyl-7,10-dioxo-5,6,8a,9-tetrahydrophenanthrene-3-carboxylic acid
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CAS No:
120092-50-4
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Formula:
C19H22O4
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Chemical Name:
(4bS,8aR)-2,4b,8,8-tetramethyl-7,10-dioxo-5,6,8a,9-tetrahydrophenanthrene-3-carboxylic acid
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Synonyms:
120092-50-4;Isomargolonone;13-methyl-3,7-dioxopodocarpa-8,11,13-triene-12-carboxylic acid;(4bS,8aR)-2,4b,8,8-tetramethyl-7,10-dioxo-5,6,8a,9-tetrahydrophenanthrene-3-carboxylic Acid;DTXSID00923220;A807795;(4bS,8aR)-2,4b,8,8-tetramethyl-7,10-bis(oxidanylidene)-5,6,8a,9-tetrahydrophenanthrene-3-carboxylic acid;3-Phenanthrenecarboxylic acid, 4b,5,6,7,8,8a,9,10-octahydro-2,4b,8,8- tetramethyl-7,10-dioxo-, (4bS-trans)-
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CAS No:
(4bS,8aR)-2,4b,8,8-tetramethyl-7,10-dioxo-5,6,8a,9-tetrahydrophenanthrene-3-carboxylic acid Basic Attributes
314.4 g/mol
314.15180918 g/mol
Computed Properties
Molecular Weight:314.4
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:314.15180918
Monoisotopic Mass:314.15180918
Topological Polar Surface Area:71.4
Heavy Atom Count:23
Complexity:564
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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