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Content language

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Concept information

Preferred term

emodacidamide d  

Type

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

Broader concept

charge

  • 0

formula

  • C22H21NO8

inchi

  • InChI=1S/C22H21NO8/c1-4-9(2)18(22(30)31-3)23-21(29)10-5-12-16(14(25)6-10)20(28)17-13(19(12)27)7-11(24)8-15(17)26/h5-9,18,24-26H,4H2,1-3H3,(H,23,29)/t9-,18-/m0/s1

inchikey

  • RHIKPDQWISFYIG-YYSFKGJASA-N

mass

  • 427.409

monoisotopicmass

  • 427.12672

smiles

  • O=C1C2=C(O)C=C(O)C=C2C(=O)C=3C1=C(O)C=C(C(=O)N[C@H](C(=O)OC)[C@H](CC)C)C3

subset

  • 2_STAR

synonym EXACT

  • methyl (2S,3S)-3-methyl-2-[(4,5,7-trihydroxy-9,10-dioxoanthracene-2-carbonyl)amino]pentanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207639

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