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1-hydroxy-13-[(3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypyrrolidin-2-yl]tridecan-5-one

Base Information
  • Chemical Name:1-hydroxy-13-[(3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypyrrolidin-2-yl]tridecan-5-one
  • CAS No.:190317-46-5
  • Molecular Formula:C24H45NO10
  • Molecular Weight:507.622
  • Hs Code.:
  • DSSTox Substance ID:DTXSID60940579
  • Wikidata:Q82917267
1-hydroxy-13-[(3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypyrrolidin-2-yl]tridecan-5-one

Synonyms:190317-46-5;1-hydroxy-13-[(3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypyrrolidin-2-yl]tridecan-5-one;C24H45NO10;C24-H45-N-O10;DTXSID60940579;4-Hydroxy-5-(hydroxymethyl)-2-(13-hydroxy-9-oxotridecyl)pyrrolidin-3-yl hexopyranoside;5-Tridecanone, 13-((2R,3R,4S,5R)-3-(.beta.-D-glucopyranosyloxy)-4-hydroxy-5-(hydroxymethyl)-2-pyrrolidinyl)-1-hydroxy-

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Chemical Property of 1-hydroxy-13-[(3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypyrrolidin-2-yl]tridecan-5-one
Chemical Property:
  • Vapor Pressure:9.52E-27mmHg at 25°C 
  • Boiling Point:761.2°C at 760 mmHg 
  • Flash Point:414.2°C 
  • Density:1.3g/cm3 
  • XLogP3:-0.4
  • Hydrogen Bond Donor Count:8
  • Hydrogen Bond Acceptor Count:11
  • Rotatable Bond Count:17
  • Exact Mass:507.30434663
  • Heavy Atom Count:35
  • Complexity:597
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MSDS Files:
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  • Canonical SMILES:C(CCCCC(=O)CCCCO)CCCC1C(C(C(N1)CO)O)OC2C(C(C(C(O2)CO)O)O)O
  • Isomeric SMILES:C(CCCCC(=O)CCCCO)CCCC1[C@H]([C@H]([C@H](N1)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
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