(1R,4S)-4-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile
-
(1R,4S)-4-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile
structure -
-
CAS No:
110115-55-4
-
Formula:
C12H17NO7
-
Chemical Name:
(1R,4S)-4-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile
-
Synonyms:
Taraktophyllin;Epipassicoriacin;SCHEMBL3191456;(1R,4S)-4-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile;2-Cyclopentene-1-carbonitrile, 1-(beta-D-glucopyranosyloxy)-4-hydroxy-, (1R-cis)-;110115-55-4
-
CAS No:
(1R,4S)-4-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile Basic Attributes
287.27 g/mol
287.10050188 g/mol
Computed Properties
Molecular Weight:287.27
XLogP3:-2.3
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:287.10050188
Monoisotopic Mass:287.10050188
Topological Polar Surface Area:143
Heavy Atom Count:20
Complexity:433
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation