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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 > organonitrogen heterocyclic compound > piperazines > 1-(1,3-benzodioxol-5-yl)-3-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > piperazines > 1-(1,3-benzodioxol-5-yl)-3-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > piperazines > 1-(1,3-benzodioxol-5-yl)-3-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > piperazines > 1-(1,3-benzodioxol-5-yl)-3-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > piperazines > 1-(1,3-benzodioxol-5-yl)-3-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea

Preferred term

1-(1,3-benzodioxol-5-yl)-3-[(2s,3s,6s)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea  

Type

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

Broader concept

charge

  • 0

formula

  • C26H32N4O6

inchi

  • InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m0/s1

inchikey

  • GZDPKZCGLLNMKC-AWRGLXIESA-N

mass

  • 496.556

monoisotopicmass

  • 496.23218

smiles

  • C1C[C@@H]([C@H](O[C@@H]1CC(=O)N2CCN(CC2)C3=CC=CC=C3)CO)NC(=O)NC4=CC5=C(C=C4)OCO5

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:118348

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