2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol, octahydro-2,2,5a,9-tetramethyl-, 6,10-diacetate 4,5-dibenzoate, (3R,4S,5R,5aS,6R,7S,9S,9aS,10R)-
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2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol, octahydro-2,2,5a,9-tetramethyl-, 6,10-diacetate 4,5-dibenzoate, (3R,4S,5R,5aS,6R,7S,9S,9aS,10R)-
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CAS No:
111514-63-7
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Formula:
C33H38O11
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Chemical Name:
2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol, octahydro-2,2,5a,9-tetramethyl-, 6,10-diacetate 4,5-dibenzoate, (3R,4S,5R,5aS,6R,7S,9S,9aS,10R)-
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Synonyms:
2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol,octahydro-2,2,5a,9-tetramethyl-,6,10-diacetate 4,5-dibenzoate,(3R,4S,5R,5aS,6R,7S,9S,9aS,10R)-;2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol,octahydro-2,2,5a,9-tetramethyl-,6,10-diacetate 4,5-dibenzoate,[3R-(3α,4β,5β,5aα,6α,7α,9β,9aα,10R*)]-;(-)-Triptofordin C 2;Triptofordin C 2
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CAS No:
2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol, octahydro-2,2,5a,9-tetramethyl-, 6,10-diacetate 4,5-dibenzoate, (3R,4S,5R,5aS,6R,7S,9S,9aS,10R)- Basic Attributes
610.6 g/mol
610.65
Computed Properties
Molecular Weight:610.6
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:610.24141202
Monoisotopic Mass:610.24141202
Topological Polar Surface Area:155
Heavy Atom Count:44
Complexity:1140
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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