(2S)-4-methyl-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]pentanoic acid
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![(2S)-4-methyl-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e786327e88d34323b423573a9b8e0165.png "(2S)-4-methyl-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]pentanoic acid")
(2S)-4-methyl-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]pentanoic acid
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CAS No:
956050-45-6
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Formula:
C23H27NO6
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Chemical Name:
(2S)-4-methyl-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]pentanoic acid
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Synonyms:
ZINC2102914;AKOS030499243;MCULE-9348820575;(S)-4-methyl-2-(3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)pentanoic acid;956050-45-6
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CAS No:
(2S)-4-methyl-2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]pentanoic acid Basic Attributes
413.5 g/mol
413.18383758 g/mol
Computed Properties
Molecular Weight:413.5
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:413.18383758
Monoisotopic Mass:413.18383758
Topological Polar Surface Area:106
Heavy Atom Count:30
Complexity:729
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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