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Concept information

Preferred term

emodacidamide g  

Type

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

Broader concept

charge

  • 0

formula

  • C21H18ClNO8

inchi

  • InChI=1S/C21H18ClNO8/c1-7(2)3-11(21(30)31)23-20(29)8-4-9-14(12(24)5-8)18(27)15-10(17(9)26)6-13(25)16(22)19(15)28/h4-7,11,24-25,28H,3H2,1-2H3,(H,23,29)(H,30,31)/t11-/m0/s1

inchikey

  • VOXKCJAIEWKHLK-NSHDSACASA-N

mass

  • 447.820

monoisotopicmass

  • 447.07209

smiles

  • ClC1=C(O)C=2C(=O)C3=C(O)C=C(C(=O)N[C@H](C(=O)O)CC(C)C)C=C3C(C2C=C1O)=O

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[(6-chloro-4,5,7-trihydroxy-9,10-dioxoanthracene-2-carbonyl)amino]-4-methylpentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207659

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