(2S)-2-[12-ethyl-8-(hydroxymethyl)-9-oxo-2-(4-piperidin-1-ylpiperidine-1-carbonyl)oxy-11H-indolizino[1,2-b]quinolin-7-yl]-2-hydroxybutanoic acid
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![(2S)-2-[12-ethyl-8-(hydroxymethyl)-9-oxo-2-(4-piperidin-1-ylpiperidine-1-carbonyl)oxy-11H-indolizino[1,2-b]quinolin-7-yl]-2-hydroxybutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6f2b2df6fd304710a1d74c3a43067ade.png "(2S)-2-[12-ethyl-8-(hydroxymethyl)-9-oxo-2-(4-piperidin-1-ylpiperidine-1-carbonyl)oxy-11H-indolizino[1,2-b]quinolin-7-yl]-2-hydroxybutanoic acid")
(2S)-2-[12-ethyl-8-(hydroxymethyl)-9-oxo-2-(4-piperidin-1-ylpiperidine-1-carbonyl)oxy-11H-indolizino[1,2-b]quinolin-7-yl]-2-hydroxybutanoic acid
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CAS No:
142706-06-7
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Formula:
C33H40N4O7
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Chemical Name:
(2S)-2-[12-ethyl-8-(hydroxymethyl)-9-oxo-2-(4-piperidin-1-ylpiperidine-1-carbonyl)oxy-11H-indolizino[1,2-b]quinolin-7-yl]-2-hydroxybutanoic acid
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Synonyms:
CHEMBL2074712;CPT 11 carboxylic acid;ZINC4099097;BDBM50485566;(4S)-4alpha,11-Diethyl-4beta-hydroxy-9-[[4-(piperidine-1-yl)piperidine-1-yl]carbonyloxy]-1,2-seco-1-hydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione;(alphaS)-alpha-Hydroxy-2-[[(1,4'-bipiperidine-1'-yl)carbonyl]oxy]-8-(hydroxymethyl)-9-oxo-alpha,12-diethyl-9,11-dihydroindolizino[1,2-b]quinoline-7-acetic acid;142706-06-7
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CAS No:
(2S)-2-[12-ethyl-8-(hydroxymethyl)-9-oxo-2-(4-piperidin-1-ylpiperidine-1-carbonyl)oxy-11H-indolizino[1,2-b]quinolin-7-yl]-2-hydroxybutanoic acid Basic Attributes
604.7 g/mol
604.28969963 g/mol
Computed Properties
Molecular Weight:604.7
XLogP3:0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:604.28969963
Monoisotopic Mass:604.28969963
Topological Polar Surface Area:144
Heavy Atom Count:44
Complexity:1190
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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