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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > azamacrocycle > (8s,9s)-9-[[(4-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2s)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-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 > (8s,9s)-9-[[(4-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2s)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one
organooxygen compound > carboxamide > lactam > (8s,9s)-9-[[(4-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2s)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-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 > (8s,9s)-9-[[(4-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2s)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-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 > (8s,9s)-9-[[(4-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2s)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one
organic heterocyclic compound > organonitrogen heterocyclic compound > lactam > (8s,9s)-9-[[(4-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2s)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one

Preferred term

(8s,9s)-9-[[(4-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2s)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one  

Type

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

Broader concept

charge

  • 0

formula

  • C23H35N5O4

inchi

  • InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1

inchikey

  • YNSZNIPNNMZZOV-NPPFBWRTSA-N

mass

  • 445.556

monoisotopicmass

  • 445.26890

smiles

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

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:97036

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