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Chemistry, part 1

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Concept information

organic aromatic compound > aromatic amine > (3r,6ar,8r,10ar)-3-hydroxy-8-[2-oxo-2-[[(3r)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-n-propyl-3,4,6,6a,8,9,10,10a-octahydro-2h-pyrano[2,3-c][1,5]oxazocine-1-carboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > aromatic amine > (3r,6ar,8r,10ar)-3-hydroxy-8-[2-oxo-2-[[(3r)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-n-propyl-3,4,6,6a,8,9,10,10a-octahydro-2h-pyrano[2,3-c][1,5]oxazocine-1-carboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > aromatic amine > (3r,6ar,8r,10ar)-3-hydroxy-8-[2-oxo-2-[[(3r)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-n-propyl-3,4,6,6a,8,9,10,10a-octahydro-2h-pyrano[2,3-c][1,5]oxazocine-1-carboxamide

Preferred term

(3r,6ar,8r,10ar)-3-hydroxy-8-[2-oxo-2-[[(3r)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-n-propyl-3,4,6,6a,8,9,10,10a-octahydro-2h-pyrano[2,3-c][1,5]oxazocine-1-carboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C26H40N4O5

inchi

  • InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23-,24+/m1/s1

inchikey

  • WWAGOAOIMIOBRQ-RMRNXIRCSA-N

mass

  • 488.621

monoisotopicmass

  • 488.29987

smiles

  • CCCNC(=O)N1C[C@H](COC[C@H]2[C@H]1CC[C@@H](O2)CC(=O)N[C@@H]3CCN(C3)CC4=CC=CC=C4)O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:100446

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