1-L-Aspartic acid-3-isoleucine-alpha-amanitin
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1-L-Aspartic acid-3-isoleucine-alpha-amanitin
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CAS No:
54532-45-5
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Formula:
C39H53N9O13S
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Chemical Name:
1-L-Aspartic acid-3-isoleucine-alpha-amanitin
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Synonyms:
Amanullinic acid;1-L-Aspartic acid-3-isoleucine-alpha-amanitin;alpha-Amanitin, 1-L-aspartic acid-3-isoleucine-;54532-45-5;Q4353556
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CAS No:
Computed Properties
Molecular Weight:888.0
XLogP3:-1.6
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:6
Exact Mass:887.34835395
Monoisotopic Mass:887.34835395
Topological Polar Surface Area:354
Heavy Atom Count:62
Complexity:1790
Undefined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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