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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 > carboxamide > peptide > tan-1057a
organooxygen compound > carboxamide > peptide > tan-1057a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > tan-1057a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > tan-1057a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > tan-1057a

Preferred term

tan-1057a  

Type

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

Broader concept

charge

  • 0

formula

  • C13H25N9O3

inchi

  • InChI=1S/C13H25N9O3/c1-22(8-6-19-13(20-10(8)24)21-12(17)25)9(23)5-7(14)3-2-4-18-11(15)16/h7-8H,2-6,14H2,1H3,(H4,15,16,18)(H4,17,19,20,21,24,25)/t7-,8-/m0/s1

inchikey

  • ZMWBCGMRXBPXEU-YUMQZZPRSA-N

mass

  • 355.403

monoisotopicmass

  • 355.20804

smiles

  • O=C1NC(=NC[C@@H]1N(C(=O)C[C@@H](N)CCCN=C(N)N)C)NC(=O)N

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-amino-N-[(5S)-2-(carbamoylamino)-6-oxo-4,5-dihydro-1H-pyrimidin-5-yl]-6-(diaminomethylideneamino)-N-methylhexanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221211

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