(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-2-(3-Furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-4H-3a,6-methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid
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![(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-2-(3-Furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-4H-3a,6-methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a047f981a6e1421da3b46f0b5a78ac1f.png "(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-2-(3-Furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-4H-3a,6-methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid")
(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-2-(3-Furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-4H-3a,6-methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid
structure -
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CAS No:
20086-07-1
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Formula:
C19H22O7
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Chemical Name:
(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-2-(3-Furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-4H-3a,6-methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid
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Synonyms:
4H-3a,6-Methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid,2-(3-furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-,(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-;4H-3a,6-Methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid,2-(3-furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-,[2R-(2α,3aβ,6β,6aβ,7α,9α,10aα,10bβ)]-;Diosbulbin C;(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-2-(3-Furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-4H-3a,6-methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid
- Categories:
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CAS No:
(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-2-(3-Furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-4H-3a,6-methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid Basic Attributes
362.4
362.37
Computed Properties
Molecular Weight:362.4
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:362.13655304
Monoisotopic Mass:362.13655304
Topological Polar Surface Area:106
Heavy Atom Count:26
Complexity:650
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(2R,3aS,6S,6aS,7R,9R,10aR,10bS)-2-(3-Furanyl)decahydro-9-hydroxy-10b-methyl-4-oxo-4H-3a,6-methanofuro[2,3-d][2]benzoxepin-7-carboxylic acid
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