3,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
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![3,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0e84266005b445c8baead0173823b19f.png "3,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde")
3,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
structure -
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CAS No:
30344-95-7
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Formula:
C24H30O6
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Chemical Name:
3,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
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Synonyms:
30344-95-7;NSC135067;3,14,16-trihydroxy-19-oxobufa-4,20,22-trienolide;DTXSID70300140;NSC251753;NSC-135067;NSC-251753;SCILLIGLAUCOSIDIN, 16-HYDROXY-;(3.BETA.,14,16-TRIHYDROXY-19-OXOBUFA-4,20,22-TRIENOLIDE;30344-96-8
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CAS No:
3,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde Basic Attributes
414.5 g/mol
414.20423867 g/mol
251753|135067
DTXSID70300140
Computed Properties
Molecular Weight:414.5
XLogP3:0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:414.20423867
Monoisotopic Mass:414.20423867
Topological Polar Surface Area:104
Heavy Atom Count:30
Complexity:873
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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