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Concept information

Preferred term

پپساتین A(1)  

Type

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

charge

  • -1

formula

  • C34H62N5O9

inchi

  • InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/p-1/t22-,23-,24-,25-,26-,30-,31-/m0/s1

inchikey

  • FAXGPCHRFPCXOO-LXTPJMTPSA-M

is_conjugate_base_of

mass

  • 684.897

monoisotopicmass

  • 684.45530

smiles

  • [C@@H](NC([C@@H](NC([C@@H](NC(CC(C)C)=O)C(C)C)=O)C(C)C)=O)([C@H](CC(N[C@H](C(N[C@H]([C@H](CC(=O)[O-])O)CC(C)C)=O)C)=O)O)CC(C)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190525

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