5-hydroxy-9,16-dimethyl-8-(6-oxopyran-3-yl)-15,17,20-trioxahexacyclo[14.3.1.114,18.01,13.04,12.05,9]henicosane-13-carbaldehyde
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5-hydroxy-9,16-dimethyl-8-(6-oxopyran-3-yl)-15,17,20-trioxahexacyclo[14.3.1.114,18.01,13.04,12.05,9]henicosane-13-carbaldehyde
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CAS No:
23044-66-8
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Formula:
C26H32O7
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Chemical Name:
5-hydroxy-9,16-dimethyl-8-(6-oxopyran-3-yl)-15,17,20-trioxahexacyclo[14.3.1.114,18.01,13.04,12.05,9]henicosane-13-carbaldehyde
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Synonyms:
NSC135077;23044-66-8;BERSALDEGENIN 1,5-ORTHOACETATE;NSC-135077;NCI60_000792
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CAS No:
5-hydroxy-9,16-dimethyl-8-(6-oxopyran-3-yl)-15,17,20-trioxahexacyclo[14.3.1.114,18.01,13.04,12.05,9]henicosane-13-carbaldehyde Basic Attributes
456.5 g/mol
456.21480336 g/mol
135077
Computed Properties
Molecular Weight:456.5
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:456.21480336
Monoisotopic Mass:456.21480336
Topological Polar Surface Area:91.3
Heavy Atom Count:33
Complexity:1000
Undefined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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