7-hydroxy-1',9a-dimethyl-1-oxo-5'-(2-oxopyran-4-yl)spiro[4,5,5a,6,7,8,9,9b-octahydro-3aH-benzo[e][2]benzofuran-3,2'-cyclopentane]-1'-carboxylic acid
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![7-hydroxy-1',9a-dimethyl-1-oxo-5'-(2-oxopyran-4-yl)spiro[4,5,5a,6,7,8,9,9b-octahydro-3aH-benzo[e][2]benzofuran-3,2'-cyclopentane]-1'-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d86ff6ae9f814700baaef451ec04c0e6.png "7-hydroxy-1',9a-dimethyl-1-oxo-5'-(2-oxopyran-4-yl)spiro[4,5,5a,6,7,8,9,9b-octahydro-3aH-benzo[e][2]benzofuran-3,2'-cyclopentane]-1'-carboxylic acid")
7-hydroxy-1',9a-dimethyl-1-oxo-5'-(2-oxopyran-4-yl)spiro[4,5,5a,6,7,8,9,9b-octahydro-3aH-benzo[e][2]benzofuran-3,2'-cyclopentane]-1'-carboxylic acid
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CAS No:
167172-84-1
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Formula:
C24H30O7
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Chemical Name:
7-hydroxy-1',9a-dimethyl-1-oxo-5'-(2-oxopyran-4-yl)spiro[4,5,5a,6,7,8,9,9b-octahydro-3aH-benzo[e][2]benzofuran-3,2'-cyclopentane]-1'-carboxylic acid
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Synonyms:
3beta-hydroxy-11,12-seco-5beta,14beta-bufa-20,22-dienolide-11,14-olide-12-oic acid;marinoic acid;Marinoic acid;167172-84-1;DTXSID80937289;7'-Hydroxy-2,9'a-dimethyl-1'-oxo-3-(2-oxo-2H-pyran-4-yl)decahydro-1'H-spiro[cyclopentane-1,3'-naphtho[1,2-c]furan]-2-carboxylic acid;Spiro(cyclopentane-1,3'(1'H)-naphtho(1,2-c)furan)-2-carboxylic acid, decahydro-7'-hydroxy-2,9'a-dimethyl-1'-oxo-3-(2-oxo-2H-pyran-4-yl)-
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CAS No:
7-hydroxy-1',9a-dimethyl-1-oxo-5'-(2-oxopyran-4-yl)spiro[4,5,5a,6,7,8,9,9b-octahydro-3aH-benzo[e][2]benzofuran-3,2'-cyclopentane]-1'-carboxylic acid Basic Attributes
430.5 g/mol
430.19915329 g/mol
Computed Properties
Molecular Weight:430.5
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:430.19915329
Monoisotopic Mass:430.19915329
Topological Polar Surface Area:110
Heavy Atom Count:31
Complexity:906
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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