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Concept information

Preferred term

Y 14556  

Type

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

charge

  • 0

formula

  • C14H20Cl2N2O5

inchi

  • InChI=1S/C14H20Cl2N2O5/c1-5(17)11(21)18-10-7-3-6(19)4-8(20)9(7)12(22)23-14(10,2)13(15)16/h5-7,10,13,19-20H,3-4,17H2,1-2H3,(H,18,21)/t5-,6-,7+,10+,14-/m0/s1

inchikey

  • JSRXKUDJDNEKAW-NTQPJNNGSA-N

mass

  • 367.220

monoisotopicmass

  • 366.07493

smiles

  • ClC(Cl)[C@]1(OC(=O)C2=C(O)C[C@H](C[C@H]2[C@H]1NC(=O)[C@@H](N)C)O)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-N-[(3S,4R,4aR,6S)-3-(dichloromethyl)-6,8-dihydroxy-3-methyl-1-oxo-4a,5,6,7-tetrahydro-4H-isochromen-4-yl]-2-aminopropanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203941

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