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 > (8r,9r)-9-[[3,4-dihydro-2h-1,5-benzodioxepin-6-ylmethyl(methyl)amino]methyl]-6-[(2r)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > lactam > (8r,9r)-9-[[3,4-dihydro-2h-1,5-benzodioxepin-6-ylmethyl(methyl)amino]methyl]-6-[(2r)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
organooxygen compound > carboxamide > lactam > (8r,9r)-9-[[3,4-dihydro-2h-1,5-benzodioxepin-6-ylmethyl(methyl)amino]methyl]-6-[(2r)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > lactam > (8r,9r)-9-[[3,4-dihydro-2h-1,5-benzodioxepin-6-ylmethyl(methyl)amino]methyl]-6-[(2r)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > lactam > (8r,9r)-9-[[3,4-dihydro-2h-1,5-benzodioxepin-6-ylmethyl(methyl)amino]methyl]-6-[(2r)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
organic heterocyclic compound > organonitrogen heterocyclic compound > lactam > (8r,9r)-9-[[3,4-dihydro-2h-1,5-benzodioxepin-6-ylmethyl(methyl)amino]methyl]-6-[(2r)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one

Preferred term

(8r,9r)-9-[[3,4-dihydro-2h-1,5-benzodioxepin-6-ylmethyl(methyl)amino]methyl]-6-[(2r)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one  

Type

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

Broader concept

charge

  • 0

formula

  • C26H39N5O5

inchi

  • InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24+/m1/s1

inchikey

  • XBPVHNZVBFLVIV-REHUZNOOSA-N

mass

  • 501.619

monoisotopicmass

  • 501.29512

smiles

  • C[C@@H]1CN(C(=O)CCCN2C(=CN=N2)CO[C@H]1CN(C)CC3=C4C(=CC=C3)OCCCO4)[C@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:96401

Download this concept:

RDF/XML TURTLE JSON-LD