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Home > Encyclopedia > 1-[3,4-dihydroxy-6-(hydroxymethyl)-5-(4,5,6-trihydroxy-3-methyloxan-2-yl)oxyoxan-2-yl]oxy-4-hydroxycyclopent-2-ene-1-carbonitrile

1-[3,4-dihydroxy-6-(hydroxymethyl)-5-(4,5,6-trihydroxy-3-methyloxan-2-yl)oxyoxan-2-yl]oxy-4-hydroxycyclopent-2-ene-1-carbonitrile

1-[3,4-dihydroxy-6-(hydroxymethyl)-5-(4,5,6-trihydroxy-3-methyloxan-2-yl)oxyoxan-2-yl]oxy-4-hydroxycyclopent-2-ene-1-carbonitrile structure

1-[3,4-dihydroxy-6-(hydroxymethyl)-5-(4,5,6-trihydroxy-3-methyloxan-2-yl)oxyoxan-2-yl]oxy-4-hydroxycyclopent-2-ene-1-carbonitrile 

structure
  • CAS No:

    97564-60-8

  • Formula:

    C18H27NO11

  • Chemical Name:

    1-[3,4-dihydroxy-6-(hydroxymethyl)-5-(4,5,6-trihydroxy-3-methyloxan-2-yl)oxyoxan-2-yl]oxy-4-hydroxycyclopent-2-ene-1-carbonitrile

  • Synonyms:

    1-Glucopyranosylosy-4-(6-deoxyallopyranosyloxy)-2-cyclopentene-1-carbonitrile; Passitrifasciatin;

  • Categories:

    Biochemical Engineering  >  Saccharides

1-[3,4-dihydroxy-6-(hydroxymethyl)-5-(4,5,6-trihydroxy-3-methyloxan-2-yl)oxyoxan-2-yl]oxy-4-hydroxycyclopent-2-ene-1-carbonitrile Basic Attributes

433.40700

433.15841068

Characteristics

202.32000

-3.55702

1.61g/cm3

752.8ºC at 760mmHg

409.1ºC

1.638

Drug Information

1-glucopyranosylosy-4-(6-deoxyallopyranosyloxy)-2-cyclopentene-1-carbonitrile

Computed Properties

Molecular Weight:433.4
XLogP3:-4
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:5
Exact Mass:433.15841068
Monoisotopic Mass:433.15841068
Topological Polar Surface Area:202
Heavy Atom Count:30
Complexity:682
Defined Atom Stereocenter Count:10
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 1-[3,4-dihydroxy-6-(hydroxymethyl)-5-(4,5,6-trihydroxy-3-methyloxan-2-yl)oxyoxan-2-yl]oxy-4-hydroxycyclopent-2-ene-1-carbonitrile

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