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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > thiosugar > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organosulfur compound > thiosugar > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organosulfur compound > thiosugar > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > thiosugar > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > thiosugar > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > thiosugar > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > thioacetal > monothioacetal > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organosulfur compound > thioacetal > monothioacetal > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organosulfur compound > thioacetal > monothioacetal > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > s-glycosyl compound > n-demethyl-7-o-demethylcelesticetin

Preferred term

n-demethyl-7-o-demethylcelesticetin  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C22H32N2O9S

inchi

  • InChI=1S/C22H32N2O9S/c1-11(25)15(24-20(30)13-6-4-8-23-13)19-17(28)16(27)18(29)22(33-19)34-10-9-32-21(31)12-5-2-3-7-14(12)26/h2-3,5,7,11,13,15-19,22-23,25-29H,4,6,8-10H2,1H3,(H,24,30)/t11-,13+,15-,16-,17+,18+,19+,22+/m0/s1

inchikey

  • GEJPGRHNEXXHBZ-PWOXNDPSSA-N

mass

  • 500.560

monoisotopicmass

  • 500.18285

smiles

  • S([C@H]1O[C@@H]([C@H](O)[C@@H]([C@H]1O)O)[C@@H](NC(=O)[C@@H]2NCCC2)[C@@H](O)C)CCOC(=O)C3=C(O)C=CC=C3

subset

  • 2_STAR

synonym EXACT

  • 2-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-[(1S,2S)-2-hydroxy-1-[[(2R)-pyrrolidine-2-carbonyl]amino]propyl]oxan-2-yl]sulanylethyl 2-hydroxybenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224062

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