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Concept information

Preferred term

bamicetin  

Type

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

Broader concept

charge

  • 0

formula

  • C28H40N6O9

inchi

  • InChI=1S/C28H40N6O9/c1-14-18(43-25-23(37)22(36)21(30-4)15(2)42-25)9-10-20(41-14)34-12-11-19(33-27(34)40)32-24(38)16-5-7-17(8-6-16)31-26(39)28(3,29)13-35/h5-8,11-12,14-15,18,20-23,25,30,35-37H,9-10,13,29H2,1-4H3,(H,31,39)(H,32,33,38,40)/t14-,15-,18+,20-,21-,22+,23-,25-,28+/m1/s1

inchikey

  • DLNZVFMLTYLOGI-DCPNSWTPSA-N

mass

  • 604.661

monoisotopicmass

  • 604.28568

smiles

  • O=C1N=C(NC(=O)C2=CC=C(NC(=O)[C@@](N)(CO)C)C=C2)C=CN1[C@@H]3O[C@@H]([C@@H](O[C@H]4O[C@@H]([C@@H](NC)[C@@H]([C@H]4O)O)C)CC3)C

subset

  • 2_STAR

synonym EXACT

  • 4-[[(2S)-2-amino-3-hydroxy-2-methylpropanoyl]amino]-N-[1-[(2R,5S,6R)-5-[(2R,3R,4S,5S,6R)-3,4-dihydroxy-6-methyl-5-(methylamino)oxan-2-yl]oxy-6-methyloxan-2-yl]-2-oxopyrimidin-4-yl]benzamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220604

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