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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 > amide > primary amide > ureas > 2-[(1r,3s,4ar,9as)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1h-pyrano[3,4-b]benzofuran-3-yl]-n,n-dimethylacetamide

Preferred term

2-[(1r,3s,4ar,9as)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1h-pyrano[3,4-b]benzofuran-3-yl]-n,n-dimethylacetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C24H29N3O6

inchi

  • InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21+,23-/m0/s1

inchikey

  • RNEATWJSKJKSLU-GBPFJNKXSA-N

mass

  • 455.504

monoisotopicmass

  • 455.20564

smiles

  • CN(C)C(=O)C[C@@H]1C[C@H]2[C@@H]([C@H](O1)CO)OC3=C2C=C(C=C3)NC(=O)NC4=CC=C(C=C4)OC

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:110331

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