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Concept information

Preferred term

glucosylsucrose derivative 3  

Type

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

Broader concept

charge

  • 0

formula

  • C30H52O26

inchi

  • InChI=1S/C30H52O26/c31-1-7-12(37)17(42)21(46)26(48-7)52-22-18(43)13(38)8(2-32)49-27(22)53-23-19(44)14(39)9(3-33)50-28(23)54-24-20(45)15(40)10(4-34)51-29(24)56-30(6-36)25(47)16(41)11(5-35)55-30/h7-29,31-47H,1-6H2/t7?,8?,9?,10?,11?,12-,13-,14-,15?,16+,17?,18?,19?,20?,21+,22?,23+,24?,25-,26-,27-,28-,29?,30+/m1/s1

inchikey

  • JFSPEAOTYUCNFS-RZNBSGJJSA-N

mass

  • 828.720

monoisotopicmass

  • 828.27468

smiles

  • O1C(O[C@@]2(OC(CO)[C@@H]([C@H]2O)O)CO)C(O[C@H]3OC([C@@H](O)C([C@@H]3O[C@H]4OC([C@@H](O)C(C4O[C@H]5OC([C@@H](O)C([C@@H]5O)O)CO)O)CO)O)CO)C(O)C(C1CO)O

subset

  • 2_STAR

synonym EXACT

  • (2R,3S,5S)-2-[(2R,5S)-2-[(2R,3S,5S)-2-[2-[(2S,3R,4R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207668

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