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

Preferred term

urukthapelstatin a  

Type

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

Broader concept

charge

  • 0

formula

  • C34H30N8O6S2

inchi

  • InChI=1S/C34H30N8O6S2/c1-5-16(3)24-28(44)35-17(4)27(43)36-19(6-2)30-37-20(12-46-30)31-38-21(13-47-31)33-40-23(15-50-33)34-39-22(14-49-34)32-42-25(29(45)41-24)26(48-32)18-10-8-7-9-11-18/h6-17,24H,5H2,1-4H3,(H,35,44)(H,36,43)(H,41,45)/b19-6-/t16-,17-,24+/m0/s1

inchikey

  • LDFMSIKUSPHBGH-GTAKYJCGSA-N

mass

  • 710.780

monoisotopicmass

  • 710.17297

smiles

  • S1C2=NC(=C1)C=3SC=C(N3)C=4OC(C5=CC=CC=C5)=C(N4)C(=O)N[C@@H](C(=O)N[C@H](C(N/C(/C6=NC(C7=NC2=CO7)=CO6)=C/C)=O)C)[C@H](CC)C

subset

  • 2_STAR

synonym EXACT

  • (20R,23S,26Z)-20-[(2S)-butan-2-yl]-26-ethylidene-23-methyl-16-phenyl-3,15,28-trioxa-7,11-dithia-19,22,25,30,31,32,33,34-octazahexacyclo[25.2.1.12,5.16,9.110,13.114,17]tetratriaconta-1(29),2(34),4,6(33),8,10(32),12,14(31),16,27(30)-decaene-18,21,24-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216376

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