(1S,2S,7R,9R,13S,14R,15S,16S,17S)-16-hydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione
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![(1S,2S,7R,9R,13S,14R,15S,16S,17S)-16-hydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b518b81e7be9466cb92e2055450c48d8.png "(1S,2S,7R,9R,13S,14R,15S,16S,17S)-16-hydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione")
(1S,2S,7R,9R,13S,14R,15S,16S,17S)-16-hydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione
structure -
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CAS No:
126167-88-2
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Formula:
C21H30O6
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Chemical Name:
(1S,2S,7R,9R,13S,14R,15S,16S,17S)-16-hydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione
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Synonyms:
javanicin A;Javanicin A;126167-88-2;DTXSID70925438;18-Norpicras-2-ene-1,16-dione, 11-hydroxy-2,12-dimethoxy-, (11alpha,12beta)-;1-Hydroxy-2,10-dimethoxy-3,11a,11c-trimethyl-2,3,3a,6a,7,7a,8,11a,11b,11c-decahydrophenanthro[10,1-bc]pyran-5,11(1H,4H)-dione
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CAS No:
(1S,2S,7R,9R,13S,14R,15S,16S,17S)-16-hydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione Basic Attributes
378.5 g/mol
378.20423867 g/mol
Computed Properties
Molecular Weight:378.5
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:378.20423867
Monoisotopic Mass:378.20423867
Topological Polar Surface Area:82.1
Heavy Atom Count:27
Complexity:701
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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