(2S)-2-(4-hydroxyphenyl)-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetic acid
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![(2S)-2-(4-hydroxyphenyl)-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c4cd143c28304bfb9ef9fbdd429be237.png "(2S)-2-(4-hydroxyphenyl)-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetic acid")
(2S)-2-(4-hydroxyphenyl)-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetic acid
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CAS No:
956047-91-9
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Formula:
C25H23NO7
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Chemical Name:
(2S)-2-(4-hydroxyphenyl)-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetic acid
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Synonyms:
ZINC2122140;EiM07-29648;STL464438;AKOS016393718;MCULE-6576667290;(2S)-(4-hydroxyphenyl){[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}acetic acid;(2S)-(4-hydroxyphenyl){[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}ethanoic acid;956047-91-9
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CAS No:
(2S)-2-(4-hydroxyphenyl)-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetic acid Basic Attributes
449.5 g/mol
449.14745207 g/mol
Computed Properties
Molecular Weight:449.5
XLogP3:3.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:449.14745207
Monoisotopic Mass:449.14745207
Topological Polar Surface Area:126
Heavy Atom Count:33
Complexity:816
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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