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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

4' دئوکسی بوتیروزین B  

Type

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

charge

  • 0

formula

  • C21H41N5O11

inchi

  • InChI=1S/C21H41N5O11/c22-2-1-10(28)19(33)26-9-4-8(24)17(36-20-13(25)11(29)3-7(5-23)34-20)16(32)18(9)37-21-15(31)14(30)12(6-27)35-21/h7-18,20-21,27-32H,1-6,22-25H2,(H,26,33)/t7-,8+,9-,10+,11-,12-,13-,14+,15+,16+,17-,18+,20-,21-/m1/s1

inchikey

  • QFLJXVOAZAHLEX-LXYUSJPUSA-N

mass

  • 539.583

monoisotopicmass

  • 539.28026

smiles

  • O=C(N[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H]([C@@H]2O)O)[C@@H](O)[C@H](O[C@H]3O[C@H](C[C@H]([C@H]3N)O)CN)[C@H](C1)N)[C@@H](O)CCN

subset

  • 2_STAR

synonym EXACT

  • (2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-[(2R,3R,4R,6R)-3-amino-6-(aminomethyl)-4-hydroxyoxan-2-yl]oxy-2-[(2S,3S,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225205

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