[(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] benzoate
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[(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] benzoate
structure -
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CAS No:
6274-07-3
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Formula:
C29H26O9
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Chemical Name:
[(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] benzoate
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Synonyms:
6274-07-3;NSC35737;(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 benzoate;CHEMBL277901;DTXSID30284114;NSC-35737
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CAS No:
[(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] benzoate Basic Attributes
518.5 g/mol
518.15768240 g/mol
35737
DTXSID30284114
Computed Properties
Molecular Weight:518.5
XLogP3:4.2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:518.15768240
Monoisotopic Mass:518.15768240
Topological Polar Surface Area:98.8
Heavy Atom Count:38
Complexity:845
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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