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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > 14,20-dideoxy-thaxtomin a
organooxygen compound > 14,20-dideoxy-thaxtomin a

Preferred term

14,20-dideoxy-thaxtomin a  

Type

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

Broader concept

charge

  • 0

formula

  • C22H22N4O4

has_functional_parent

inchi

  • InChI=1S/C22H22N4O4/c1-24-18(11-14-7-4-3-5-8-14)21(27)25(2)19(22(24)28)12-15-13-23-16-9-6-10-17(20(15)16)26(29)30/h3-10,13,18-19,23H,11-12H2,1-2H3/t18?,19-/m0/s1

inchikey

  • GJJXGBLNXDIHIQ-GGYWPGCISA-N

mass

  • 406.442

monoisotopicmass

  • 406.16411

smiles

  • O=[N+]([O-])C1=C2C(NC=C2C[C@@H]3N(C(=O)C(CC4=CC=CC=C4)N(C3=O)C)C)=CC=C1

subset

  • 2_STAR

synonym EXACT

  • (6S)-3-benzyl-1,4-dimethyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203237

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