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

Preferred term

bagougeramine b  

Type

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

Broader concept

charge

  • 0

formula

  • C24H44N12O7

inchi

  • InChI=1S/C24H44N12O7/c1-29-12-15(37)33-13(11-32-23(27)28)20(40)35-16-17(38)18(39)22(36-10-5-14(26)34-24(36)42)43-19(16)21(41)31-9-4-8-30-7-3-2-6-25/h5,10,13,16-19,22,29-30,38-39H,2-4,6-9,11-12,25H2,1H3,(H,31,41)(H,33,37)(H,35,40)(H2,26,34,42)(H4,27,28,32)/t13-,16+,17+,18-,19-,22-/m1/s1

inchikey

  • LCASODQCASDDLN-MBVCZAKJSA-N

mass

  • 612.693

monoisotopicmass

  • 612.34559

smiles

  • O=C1N=C(N)C=CN1[C@@H]2O[C@@H](C(=O)NCCCNCCCCN)[C@@H](NC(=O)[C@H](NC(=O)CNC)CN=C(N)N)[C@@H]([C@H]2O)O

subset

  • 2_STAR

synonym EXACT

  • (2R,3S,4S,5R,6R)-N-[3-(4-aminobutylamino)propyl]-6-(4-amino-2-oxopyrimidin-1-yl)-3-[[(2R)-3-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]propanoyl]amino]-4,5-dihydroxyoxane-2-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222436

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