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

Preferred term

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

Type

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

Broader concept

charge

  • 0

formula

  • C26H31N3O6

inchi

  • InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m0/s1

inchikey

  • SRZDSTZFHOVQBI-YALMDMJRSA-N

mass

  • 481.542

monoisotopicmass

  • 481.22129

smiles

  • COC1=CC=C(C=C1)NC(=O)NC2=CC3=C(C=C2)O[C@@H]4[C@H]3C[C@H](O[C@H]4CO)CC(=O)NCC5CC5

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:122827

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