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 > n'-(2-aminophenyl)-n-[(3s,9s,10s)-9-[(dimethylamino)methyl]-12-[(2s)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]heptanediamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > lactam > n'-(2-aminophenyl)-n-[(3s,9s,10s)-9-[(dimethylamino)methyl]-12-[(2s)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]heptanediamide
organooxygen compound > carboxamide > lactam > n'-(2-aminophenyl)-n-[(3s,9s,10s)-9-[(dimethylamino)methyl]-12-[(2s)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]heptanediamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > lactam > n'-(2-aminophenyl)-n-[(3s,9s,10s)-9-[(dimethylamino)methyl]-12-[(2s)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]heptanediamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > lactam > n'-(2-aminophenyl)-n-[(3s,9s,10s)-9-[(dimethylamino)methyl]-12-[(2s)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]heptanediamide
organic heterocyclic compound > organonitrogen heterocyclic compound > lactam > n'-(2-aminophenyl)-n-[(3s,9s,10s)-9-[(dimethylamino)methyl]-12-[(2s)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]heptanediamide

Preferred term

n'-(2-aminophenyl)-n-[(3s,9s,10s)-9-[(dimethylamino)methyl]-12-[(2s)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]heptanediamide  

Type

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

Broader concept

charge

  • 0

formula

  • C36H55N5O6

inchi

  • InChI=1S/C36H55N5O6/c1-25-22-41(26(2)24-42)36(45)29-21-28(18-19-32(29)47-27(3)13-11-12-20-46-33(25)23-40(4)5)38-34(43)16-7-6-8-17-35(44)39-31-15-10-9-14-30(31)37/h9-10,14-15,18-19,21,25-27,33,42H,6-8,11-13,16-17,20,22-24,37H2,1-5H3,(H,38,43)(H,39,44)/t25-,26-,27-,33+/m0/s1

inchikey

  • PNYYFPKFZGOVKX-CLFOAKAGSA-N

mass

  • 653.853

monoisotopicmass

  • 653.41523

smiles

  • C[C@H]1CCCCO[C@@H]([C@H](CN(C(=O)C2=C(O1)C=CC(=C2)NC(=O)CCCCCC(=O)NC3=CC=CC=C3N)[C@@H](C)CO)C)CN(C)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:130356

Download this concept:

RDF/XML TURTLE JSON-LD