Aloe resin A
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Aloe resin A
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CAS No:
74545-79-2
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Formula:
C28H28O11
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Chemical Name:
Aloe resin A
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Synonyms:
4H-1-Benzopyran-4-one,7-hydroxy-8-[2-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-glucopyranosyl]-5-methyl-2-(2-oxopropyl)-;2-Propenoic acid,3-(4-hydroxyphenyl)-,2′-ester with 8-β-D-glucopyranosyl-7-hydroxy-5-methyl-2-(2-oxopropyl)-4H-1-benzopyran-4-one,(E)-;4H-1-Benzopyran-4-one,7-hydroxy-8-[2-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-β-D-glucopyranosyl]-5-methyl-2-(2-oxopropyl)-;7-Hydroxy-8-[2-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-glucopyranosyl]-5-methyl-2-(2-oxopropyl)-4H-1-benzopyran-4-one;Aloe resin A;4H-1-Benzopyran-4-one,7-hydroxy-8-[2-O-[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-β-D-glucopyranosyl]-5-methyl-2-(2-oxopropyl)-,(E)-
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CAS No:
Computed Properties
Molecular Weight:540.5
XLogP3:1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:8
Exact Mass:540.16316171
Monoisotopic Mass:540.16316171
Topological Polar Surface Area:180
Heavy Atom Count:39
Complexity:969
Defined Atom Stereocenter Count:5
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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