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Concept information

Preferred term

مامانایسین B  

Type

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

charge

  • 0

formula

  • C28H34N2O7

inchi

  • InChI=1S/C28H34N2O7/c1-4-5-10-17(2)15-18(3)27(35)29-19-16-28(36,26-25(37-26)24(19)34)14-9-7-6-8-11-22(33)30-23-20(31)12-13-21(23)32/h6-9,11,14-17,25-26,31,36H,4-5,10,12-13H2,1-3H3,(H,29,35)(H,30,33)/b7-6+,11-8+,14-9+,18-15+/t17-,25+,26+,28-/m0/s1

inchikey

  • ZGICGDCGECBVTD-KOWWZHDJSA-N

mass

  • 510.587

monoisotopicmass

  • 510.23660

smiles

  • O=C1C(NC(=O)/C(=C/[C@H](CCCC)C)/C)=C[C@@](O)(/C=C/C=C/C=C/C(=O)NC2=C(O)CCC2=O)[C@H]3[C@@H]1O3

subset

  • 2_STAR

synonym EXACT

  • (E,4S)-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-7-oxohepta-1,3,5-trienyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-2,4-dimethyloct-2-enamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221116

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