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Chemistry, part 1

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... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > azamacrocycle > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfuric acid derivative > sulfates > organic sulfate > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > sulfates > organic sulfate > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfuric acid derivative > organic sulfate > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > organic sulfate > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > organooxygen compound > ester > sulfuric ester > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfuric acid derivative > sulfuric ester > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > sulfuric ester > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > aminoglycan > glycosaminoglycan > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > polysaccharide derivative > aminoglycan > glycosaminoglycan > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > biomacromolecule > polysaccharide derivative > aminoglycan > glycosaminoglycan > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > polyatomic entity > macromolecule > biomacromolecule > polysaccharide derivative > aminoglycan > glycosaminoglycan > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > aminoglycan > glycosaminoglycan > mucopolysaccharide > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > polysaccharide derivative > aminoglycan > glycosaminoglycan > mucopolysaccharide > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > biomacromolecule > polysaccharide derivative > aminoglycan > glycosaminoglycan > mucopolysaccharide > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > polyatomic entity > macromolecule > biomacromolecule > polysaccharide derivative > aminoglycan > glycosaminoglycan > mucopolysaccharide > keratan sulfate > keratan 6'-sulfate > [(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate

Preferred term

[(5r,6e,8e,10e,13s,14r,15r,16z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2r)-2-(2-methylpropanoylamino)propanoate  

Type

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

Broader concept

charge

  • 0

formula

  • C33H46N2O7

inchi

  • InChI=1S/C33H46N2O7/c1-21(2)32(39)34-24(5)33(40)42-29-16-11-9-7-8-10-15-28(41-6)20-30(37)35-26-17-25(18-27(36)19-26)14-12-13-22(3)31(38)23(29)4/h7-11,13,15,17-19,21,23-24,28-29,31,36,38H,12,14,16,20H2,1-6H3,(H,34,39)(H,35,37)/b8-7+,11-9+,15-10+,22-13-/t23-,24+,28-,29-,31-/m0/s1

inchikey

  • KPTPBSALIDLRFH-UMHDIFAFSA-N

mass

  • 582.738

monoisotopicmass

  • 582.33050

smiles

  • O=C1NC2=CC(O)=CC(=C2)CCC=C([C@H](O)[C@@H](C)[C@H](CC=CC=CC=C[C@@H](C1)OC)OC(=O)[C@H](NC(=O)C(C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • [(5R,6E,8E,10E,13S,14R,15R,16Z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2R)-2-(2-methylpropanoylamino)propanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227422

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