(4S,4aR,7aR,8R,9aR)-4,4a,7a,8,9,9a-Hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethylazuleno[6,5-b]furan-2,5-dione
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![(4S,4aR,7aR,8R,9aR)-4,4a,7a,8,9,9a-Hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethylazuleno[6,5-b]furan-2,5-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3adc422f119446b38b8a67b4a2fcbf94.png "(4S,4aR,7aR,8R,9aR)-4,4a,7a,8,9,9a-Hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethylazuleno[6,5-b]furan-2,5-dione")
(4S,4aR,7aR,8R,9aR)-4,4a,7a,8,9,9a-Hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethylazuleno[6,5-b]furan-2,5-dione
structure -
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CAS No:
71013-32-6
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Formula:
C15H18O5
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Chemical Name:
(4S,4aR,7aR,8R,9aR)-4,4a,7a,8,9,9a-Hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethylazuleno[6,5-b]furan-2,5-dione
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Synonyms:
Azuleno[6,5-b]furan-2,5-dione,4,4a,7a,8,9,9a-hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethyl-,(4S,4aR,7aR,8R,9aR)-;Azuleno[6,5-b]furan-2,5-dione,4,4a,7a,8,9,9a-hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethyl-,[4S-(4α,4aβ,7aα,8α,9aα)]-;(4S,4aR,7aR,8R,9aR)-4,4a,7a,8,9,9a-Hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethylazuleno[6,5-b]furan-2,5-dione;Isohelenol
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CAS No:
(4S,4aR,7aR,8R,9aR)-4,4a,7a,8,9,9a-Hexahydro-4-hydroxy-3-(hydroxymethyl)-4a,8-dimethylazuleno[6,5-b]furan-2,5-dione Basic Attributes
278.30 g/mol
278.30
DTXSID70221245
Computed Properties
Molecular Weight:278.30
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:278.11542367
Monoisotopic Mass:278.11542367
Topological Polar Surface Area:83.8
Heavy Atom Count:20
Complexity:547
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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