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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

n-acetylneuraminlactose sulfate  

Type

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

charge

  • 0

formula

  • C23H39NO22S

inchi

  • InChI=1S/C23H39NO22S/c1-6(27)24-11-7(28)2-23(22(36)37,45-18(11)12(30)8(29)3-25)46-19-13(31)10(5-41-47(38,39)40)43-21(16(19)34)44-17-9(4-26)42-20(35)15(33)14(17)32/h7-21,25-26,28-35H,2-5H2,1H3,(H,24,27)(H,36,37)(H,38,39,40)/t7-,8+,9+,10+,11+,12+,13-,14+,15+,16+,17+,18+,19-,20?,21-,23-/m0/s1

inchikey

  • DGUVEDGWGJXFCX-METZQCMUSA-N

mass

  • 713.610

monoisotopicmass

  • 713.16844

smiles

  • [H]C1(OC(CC(O)C1NC(C)=O)(OC1C(O)C(COS(O)(=O)=O)OC(OC2C(O)C(O)C(O)OC2CO)C1O)C(O)=O)C(O)C(O)CO

subset

  • 3_STAR

synonym EXACT

  • 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-6-O-sulfo-beta-D-galactopyranosyl-(1->4)-D-glucopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:153518

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