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Concept information

Preferred term

اپی فومونیسین B3  

Type

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

Broader concept

charge

  • 0

formula

  • C34H59NO14

inchi

  • InChI=1S/C34H59NO14/c1-5-6-11-21(3)32(49-31(43)19-24(34(46)47)17-29(40)41)27(48-30(42)18-23(33(44)45)16-28(38)39)15-20(2)14-25(36)12-9-7-8-10-13-26(37)22(4)35/h20-27,32,36-37H,5-19,35H2,1-4H3,(H,38,39)(H,40,41)(H,44,45)(H,46,47)/t20-,21+,22-,23+,24+,25+,26+,27-,32+/m0/s1

inchikey

  • CPCRJSQNWHCGOP-JRADOTLWSA-N

mass

  • 705.839

monoisotopicmass

  • 705.39356

smiles

  • O=C(O)[C@@H](CC(=O)O[C@@H]([C@@H](OC(=O)C[C@H](C(=O)O)CC(=O)O)C[C@H](C[C@H](O)CCCCCC[C@@H](O)[C@@H](N)C)C)[C@@H](CCCC)C)CC(=O)O

subset

  • 2_STAR

synonym EXACT

  • (2R)-2-[2-[(5R,6R,7S,9S,11R,18R,19S)-19-amino-6-[(3R)-3,4-dicarboxybutanoyl]oxy-11,18-dihydroxy-5,9-dimethylicosan-7-yl]oxy-2-oxoethyl]butanedioic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199308

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