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Concept information

Preferred term

اگزالیسین A  

Type

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

Broader concept

charge

  • 0

formula

  • C30H33NO6

inchi

  • InChI=1S/C30H33NO6/c1-17(2)20-9-11-28(4)23(29(20)12-10-24(32)35-16-29)8-7-18(3)30(28)26(33)25-22(37-30)14-21(36-27(25)34)19-6-5-13-31-15-19/h5-7,13-15,20,23,26,33H,1,8-12,16H2,2-4H3/t20-,23-,26-,28+,29+,30+/m0/s1

inchikey

  • HYMLFCZXNWRIQS-RZUCXZKQSA-N

mass

  • 503.595

monoisotopicmass

  • 503.23079

smiles

  • O=C1OC(C2=CN=CC=C2)=CC3=C1[C@H](O)[C@@]4(C(=CC[C@H]5[C@]4(CC[C@H]([C@@]56COC(=O)CC6)C(=C)C)C)C)O3

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224354

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