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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 > 2-oxo-3(r)-hydroxy-13-n-desmethyl-lyngbyatoxin a
organooxygen compound > carboxamide > peptide > 2-oxo-3(r)-hydroxy-13-n-desmethyl-lyngbyatoxin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > 2-oxo-3(r)-hydroxy-13-n-desmethyl-lyngbyatoxin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > 2-oxo-3(r)-hydroxy-13-n-desmethyl-lyngbyatoxin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > 2-oxo-3(r)-hydroxy-13-n-desmethyl-lyngbyatoxin a

Preferred term

2-oxo-3(r)-hydroxy-13-n-desmethyl-lyngbyatoxin a  

Type

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

Broader concept

charge

  • 0

formula

  • C26H37N3O4

inchi

  • InChI=1S/C26H37N3O4/c1-7-25(6,12-8-9-15(2)3)18-10-11-19-20-22(18)29-24(32)26(20,33)13-17(14-30)27-23(31)21(28-19)16(4)5/h7,9-11,16-17,21,28,30,33H,1,8,12-14H2,2-6H3,(H,27,31)(H,29,32)/t17-,21-,25-,26+/m0/s1

inchikey

  • IYWSJDFNYQWKPV-URWKRNFESA-N

mass

  • 455.599

monoisotopicmass

  • 455.27841

smiles

  • O=C1N[C@@H](C[C@]2(O)C(=O)NC=3C2=C(N[C@H]1C(C)C)C=CC3[C@@](C=C)(CCC=C(C)C)C)CO

subset

  • 2_STAR

synonym EXACT

  • (1R,10S,13S)-5-[(3R)-3,7-dimethylocta-1,6-dien-3-yl]-1-hydroxy-13-(hydroxymethyl)-10-propan-2-yl-3,9,12-triazatricyclo[6.6.1.04,15]pentadeca-4,6,8(15)-triene-2,11-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227075

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