(2S)-4-[(8R,13R)-8,13-dihydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
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![(2S)-4-[(8R,13R)-8,13-dihydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d1131230280a4763af6f15e1fbc4abb0.png "(2S)-4-[(8R,13R)-8,13-dihydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one")
(2S)-4-[(8R,13R)-8,13-dihydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
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CAS No:
177535-00-1
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Formula:
C37H68O6
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Chemical Name:
(2S)-4-[(8R,13R)-8,13-dihydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
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Synonyms:
longicoricin;Longicoricin;177535-00-1;2(5H)-Furanone, 3-((8R,13R)-8,13-dihydroxy-13-((2R,5R)-tetrahydro-5-((1R)-1-hydroxypentadecyl)-2-furanyl)tridecyl)-5-methyl-, (5S)-;SCHEMBL14666085;DTXSID50170328;(2S)-4-[(8R,13R)-8,13-dihydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one;2(5H)-Furanone, 3-(8,13-dihydroxy-13-(tetrahydro-5-(1-hydroxypentadecyl)-2-furanyl)tridecyl)-5-methyl-, (2R-(2alpha(1(S*),8R*,13R*),5beta(R*)))-
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CAS No:
(2S)-4-[(8R,13R)-8,13-dihydroxy-13-[(2R,5R)-5-[(1R)-1-hydroxypentadecyl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one Basic Attributes
608.9 g/mol
608.50158988 g/mol
DTXSID50170328
Computed Properties
Molecular Weight:608.9
XLogP3:11
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:28
Exact Mass:608.50158988
Monoisotopic Mass:608.50158988
Topological Polar Surface Area:96.2
Heavy Atom Count:43
Complexity:724
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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