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Chemistry, part 1

Content language

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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 > 12-n-methyl-14-hydroxycyclo-(l-4-nitrotryptophyl-l-phenylalanyl)
organooxygen compound > 12-n-methyl-14-hydroxycyclo-(l-4-nitrotryptophyl-l-phenylalanyl)

Preferred term

12-n-methyl-14-hydroxycyclo-(l-4-nitrotryptophyl-l-phenylalanyl)  

Type

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

Broader concept

charge

  • 0

formula

  • C21H20N4O5

has_functional_parent

inchi

  • InChI=1S/C21H20N4O5/c1-24-17(10-14-12-22-15-8-5-9-16(18(14)15)25(29)30)19(26)23-21(28,20(24)27)11-13-6-3-2-4-7-13/h2-9,12,17,22,28H,10-11H2,1H3,(H,23,26)/t17-,21+/m0/s1

inchikey

  • CRDXCBHAFGPWRN-LAUBAEHRSA-N

mass

  • 408.414

monoisotopicmass

  • 408.14337

smiles

  • O=[N+]([O-])C1=C2C(NC=C2C[C@@H]3N(C(=O)[C@](O)(CC4=CC=CC=C4)NC3=O)C)=CC=C1

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212540

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