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Concept information

Preferred term

fimsbactin a  

Type

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

Broader concept

charge

  • 0

formula

  • C26H30N4O11

inchi

  • InChI=1S/C26H30N4O11/c1-14(31)30(39)11-3-2-10-27-23(36)17(13-41-26(38)16-7-5-9-20(33)22(16)35)28-24(37)18-12-40-25(29-18)15-6-4-8-19(32)21(15)34/h4-9,17-18,32-35,39H,2-3,10-13H2,1H3,(H,27,36)(H,28,37)/t17-,18-/m0/s1

inchikey

  • GUYAPGULLNBOCI-ROUUACIJSA-N

mass

  • 574.543

monoisotopicmass

  • 574.19111

smiles

  • O=C(OC[C@H](NC(=O)[C@H]1N=C(C2=C(O)C(O)=CC=C2)OC1)C(=O)NCCCCN(O)C(=O)C)C3=C(O)C(O)=CC=C3

subset

  • 2_STAR

synonym EXACT

  • [(2S)-3-[4-[acetyl(hydroxy)amino]butylamino]-2-[[(4S)-2-(2,3-dihydroxyphenyl)-4,5-dihydro-1,3-oxazole-4-carbonyl]amino]-3-oxopropyl] 2,3-dihydroxybenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204125

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