skip to main content

Content language

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

Concept information

Preferred term

7 epi cylindrospermopsin zwitterion  

Type

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

Broader concept

charge

  • 0

formula

  • C15H21N5O7S

inchi

  • InChI=1S/C15H21N5O7S/c1-6-10-5-16-14-17-8(13(22)9-4-12(21)19-15(23)18-9)2-7(20(10)14)3-11(6)27-28(24,25)26/h4,6-8,10-11,13,22H,2-3,5H2,1H3,(H4,16,17,18,19,21,23,24,25,26)/t6-,7+,8-,10-,11+,13+/m1/s1

inchikey

  • KDNLTVRXCBZFNF-YUQKHPEDSA-N

mass

  • 415.420

monoisotopicmass

  • 415.11617

smiles

  • [C@@]12(C[C@@H]([C@@H]([C@@]3([N+]1=C(N[C@](C2)([C@@H](C4=CC(NC(N4)=O)=O)O)[H])NC3)[H])C)OS([O-])(=O)=O)[H]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:143707

Download this concept: