4-[[(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]oxy]-4-oxobutanoic acid;propan-2-amine
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![4-[[(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]oxy]-4-oxobutanoic acid;propan-2-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f406327787bc4fa294c6203f70237289.png "4-[[(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]oxy]-4-oxobutanoic acid;propan-2-amine")
4-[[(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]oxy]-4-oxobutanoic acid;propan-2-amine
structure -
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CAS No:
6274-05-1
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Formula:
C29H35NO11
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Chemical Name:
4-[[(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]oxy]-4-oxobutanoic acid;propan-2-amine
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Synonyms:
6274-05-1;4-oxo-4-{[(5r,5ar,8ar,9r)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl]oxy}butanoic acid- propan-2-amine(1:1);DTXSID10284112;NSC35732;NSC-35732;Naphtho[2,3-dioxole-6-carboxylic acid, 5,6,7,8-tetrahydro-8-hydroxy-7-(hyddroxymethyl)-5-(3,4,5-trimethoxyphenyl)-, .gamma.-lactone, hydrogen succinate compd. with isopropylamine
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CAS No:
4-[[(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]oxy]-4-oxobutanoic acid;propan-2-amine Basic Attributes
573.6 g/mol
573.22101093 g/mol
35732
DTXSID10284112
Computed Properties
Molecular Weight:573.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:573.22101093
Monoisotopic Mass:573.22101093
Topological Polar Surface Area:162
Heavy Atom Count:41
Complexity:860
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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