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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > salt > organic salt > maleate salt > ergometrine maleate

Preferred term

ergometrine maleate  

Type

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

Broader concept

charge

  • 0

formula

  • C23H27N3O6

has_part

has_role

inchi

  • InChI=1S/C19H23N3O2.C4H4O4/c1-11(10-23)21-19(24)13-6-15-14-4-3-5-16-18(14)12(8-20-16)7-17(15)22(2)9-13;5-3(6)1-2-4(7)8/h3-6,8,11,13,17,20,23H,7,9-10H2,1-2H3,(H,21,24);1-2H,(H,5,6)(H,7,8)/b;2-1-/t11-,13+,17+;/m0./s1

inchikey

  • YREISLCRUMOYAY-IIPCNOPRSA-N

mass

  • 441.47700

monoisotopicmass

  • 441.18999

smiles

  • OC(=O)/C=C/C(O)=O.[H][C@@]12Cc3c[nH]c4cccc(C1=C[C@H](CN2C)C(=O)N[C@@H](C)CO)c34

subset

  • 3_STAR

synonym EXACT

  • N-[(2S)-1-hydroxypropan-2-yl]-6-methyl-9,10-didehydroergoline-8beta-carboxamide (2Z)-but-2-enedioate

synonym RELATED

  • 9,10-didehydro-N-((S)-2-hydroxy-1-methylethyl)-6-methylergoline-8beta-carboxamide maleate (1:1)
  • ergometrin acid maleate
  • ergometrine hydrogen maleate
  • ergometrine maleate (1:1)
  • ergonovine hydrogen maleate
  • ergonovine maleate
  • ergonovine, maleate (1:1)

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:31554

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