skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > azamacrocycle > 1-(3-fluorophenyl)-3-[(4s,7r,8s)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > lactam > 1-(3-fluorophenyl)-3-[(4s,7r,8s)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
organooxygen compound > carboxamide > lactam > 1-(3-fluorophenyl)-3-[(4s,7r,8s)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > lactam > 1-(3-fluorophenyl)-3-[(4s,7r,8s)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > lactam > 1-(3-fluorophenyl)-3-[(4s,7r,8s)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea
organic heterocyclic compound > organonitrogen heterocyclic compound > lactam > 1-(3-fluorophenyl)-3-[(4s,7r,8s)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea

Preferred term

1-(3-fluorophenyl)-3-[(4s,7r,8s)-8-methoxy-4,7,10-trimethyl-11-oxo-5-propyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea  

Type

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

Broader concept

charge

  • 0

formula

  • C27H37FN4O4

inchi

  • InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m1/s1

inchikey

  • ACQKEKFFNOLIKU-HHJKRLRDSA-N

mass

  • 500.607

monoisotopicmass

  • 500.27988

smiles

  • CCCN1C[C@H]([C@@H](CN(C(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC(=CC=C3)F)OC[C@@H]1C)C)OC)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:104269

Download this concept:

RDF/XML TURTLE JSON-LD