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Concept information

Preferred term

TMC 86B  

Type

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

charge

  • 0

formula

  • C20H34N2O7

inchi

  • InChI=1S/C20H34N2O7/c1-13(2)9-14(17(26)20(11-24)12-29-20)22-18(27)15(10-23)21-16(25)7-5-6-8-19(3,4)28/h14-15,23-24,28H,1,5-12H2,2-4H3,(H,21,25)(H,22,27)/t14?,15-,20?/m0/s1

inchikey

  • UUYGJEDLSUBYHW-CHWWFWEZSA-N

mass

  • 414.49320

monoisotopicmass

  • 414.23660

smiles

  • CC(=C)CC(NC(=O)[C@H](CO)NC(=O)CCCCC(C)(C)O)C(=O)C1(CO)CO1

subset

  • 3_STAR

synonym EXACT

  • 6-hydroxy-N-[(2S)-3-hydroxy-1-({1-[2-(hydroxymethyl)oxiran-2-yl]-4-methyl-1-oxopent-4-en-2-yl}amino)-1-oxopropan-2-yl]-6-methylheptanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:66243

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