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Concept information

Preferred term

n,n',n'',n'''-tetraacetylchitotetraono-1,5-lactone  

Type

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

Broader concept

charge

  • 0

formula

  • C32H52N4O21

inchi

  • InChI=1S/C32H52N4O21/c1-9(41)33-17-23(47)26(14(6-38)51-29(17)50)55-31-19(35-11(3)43)25(49)28(16(8-40)53-31)57-32-20(36-12(4)44)24(48)27(15(7-39)54-32)56-30-18(34-10(2)42)22(46)21(45)13(5-37)52-30/h13-28,30-32,37-40,45-49H,5-8H2,1-4H3,(H,33,41)(H,34,42)(H,35,43)(H,36,44)/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,30+,31+,32+/m1/s1

inchikey

  • ZWAGRNFKEYEKAL-GIWPWQNKSA-N

mass

  • 828.775

monoisotopicmass

  • 828.31240

smiles

  • O([C@H]1[C@@H]([C@H]([C@H](O[C@H]2[C@@H]([C@H]([C@H](O[C@H]3[C@@H]([C@H]([C@H](O)[C@H](O3)CO)O)NC(=O)C)[C@H](O2)CO)O)NC(=O)C)[C@H](O1)CO)O)NC(=O)C)[C@@H]4[C@H](OC(=O)[C@@H]([C@H]4O)NC(=O)C)CO

subset

  • 2_STAR

synonym EXACT

  • N,N',N'',N'''-tetraacetylchitotetraono-1,5-lactone

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:143143

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