skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > oligopeptide > bicornutin a2
organooxygen compound > carboxamide > peptide > oligopeptide > bicornutin a2
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > oligopeptide > bicornutin a2
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > oligopeptide > bicornutin a2
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > oligopeptide > bicornutin a2

Preferred term

bicornutin a2  

Type

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

Broader concept

charge

  • 0

formula

  • C38H70N18O5

inchi

  • InChI=1S/C38H70N18O5/c1-23(2)22-29(56-30(57)25(39)12-6-17-49-35(40)41)34(61)55-28(15-9-20-52-38(46)47)33(60)54-27(14-8-19-51-37(44)45)32(59)53-26(13-7-18-50-36(42)43)31(58)48-21-16-24-10-4-3-5-11-24/h3-5,10-11,23,25-29H,6-9,12-22,39H2,1-2H3,(H,48,58)(H,53,59)(H,54,60)(H,55,61)(H,56,57)(H4,40,41,49)(H4,42,43,50)(H4,44,45,51)(H4,46,47,52)/t25-,26+,27-,28-,29+/m0/s1

inchikey

  • IQPCVCCHGSBSRI-UCWKTGAJSA-N

mass

  • 859.099

monoisotopicmass

  • 858.57766

smiles

  • O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)NCCC1=CC=CC=C1)CCCN=C(N)N)CCCN=C(N)N)CCCN=C(N)N)[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)CC(C)C

subset

  • 2_STAR

synonym EXACT

  • (2R)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-N-[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-5-(diaminomethylideneamino)-1-[[(2R)-5-(diaminomethylideneamino)-1-oxo-1-(2-phenylethylamino)pentan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]-4-methylpentanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221905

Download this concept:

RDF/XML TURTLE JSON-LD