(3E)-30-(2,10-disulfooxyundecyl)-2-oxo-16,18-disulfooxy-1-oxacyclotria cont-3-ene
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(3E)-30-(2,10-disulfooxyundecyl)-2-oxo-16,18-disulfooxy-1-oxacyclotria cont-3-ene
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CAS No:
85756-56-5
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Formula:
C40H76O18S4
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Chemical Name:
(3E)-30-(2,10-disulfooxyundecyl)-2-oxo-16,18-disulfooxy-1-oxacyclotria cont-3-ene
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Synonyms:
CTK5F5726;Oxacyclotriacont-3-en-2-one,30-[2,10-bis(sulfooxy)undecyl]-16,18-bis(sulfooxy)- (9CI)
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CAS No:
(3E)-30-(2,10-disulfooxyundecyl)-2-oxo-16,18-disulfooxy-1-oxacyclotria cont-3-ene Basic Attributes
973.3 g/mol
972.39145 g/mol
Computed Properties
Molecular Weight:973.3
XLogP3:11.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:18
Exact Mass:972.39145027
Monoisotopic Mass:972.39145027
Topological Polar Surface Area:314
Heavy Atom Count:62
Complexity:1630
Undefined Atom Stereocenter Count:5
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
(3E)-30-(2,10-disulfooxyundecyl)-2-oxo-16,18-disulfooxy-1-oxacyclotria cont-3-ene
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