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Concept information

Preferred term

Ciraparantag  

Type

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

charge

  • 0

formula

  • C22H48N12O2

inchi

  • InChI=1S/C22H48N12O2/c23-17(5-1-7-31-21(25)26)19(35)29-9-3-11-33-13-15-34(16-14-33)12-4-10-30-20(36)18(24)6-2-8-32-22(27)28/h17-18H,1-16,23-24H2,(H,29,35)(H,30,36)(H4,25,26,31)(H4,27,28,32)/t17-,18-/m0/s1

inchikey

  • HRDUUSCYRPOMSO-ROUUACIJSA-N

mass

  • 512.708

monoisotopicmass

  • 512.40232

smiles

  • O=C(NCCCN1CCN(CC1)CCCNC(=O)[C@@H](N)CCCN=C(N)N)[C@@H](N)CCCN=C(N)N

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-amino-N-[3-[4-[3-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]propyl]piperazin-1-yl]propyl]-5-(diaminomethylideneamino)pentanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230136

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