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

Concept information

Preferred term

sorbistin a1  

Type

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

Broader concept

charge

  • 0

formula

  • C15H31N3O9

inchi

  • InChI=1S/C15H31N3O9/c1-2-9(23)18-11-8(5-20)26-15(13(25)12(11)24)27-14(6(21)3-16)10(17)7(22)4-19/h6-8,10-15,19-22,24-25H,2-5,16-17H2,1H3,(H,18,23)/t6-,7+,8?,10+,11+,12?,13?,14+,15+/m0/s1

inchikey

  • JFNOZOIQSSNDRN-UQOUMQKUSA-N

mass

  • 397.425

monoisotopicmass

  • 397.20603

smiles

  • O=C(N[C@H]1C(O)C(O)[C@@H](O[C@@H]([C@H](N)[C@H](O)CO)[C@@H](O)CN)OC1CO)CC

subset

  • 2_STAR

synonym EXACT

  • N-[(3S,6R)-6-[(2S,3S,4R,5S)-1,4-diamino-2,5,6-trihydroxyhexan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]propanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223896

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