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... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > azamacrocycle > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > organooxygen compound > ester > sulfuric ester > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > polysaccharide derivative > aminoglycan > glycosaminoglycan > mucopolysaccharide > keratan sulfate > keratan 6'-sulfate > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-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 > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-yl] (2r)-2-(2-methylpropanoylamino)propanoate
... > chemical entity > molecular entity > polyatomic entity > macromolecule > biomacromolecule > polysaccharide derivative > aminoglycan > glycosaminoglycan > mucopolysaccharide > keratan sulfate > keratan 6'-sulfate > [(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-yl] (2r)-2-(2-methylpropanoylamino)propanoate

Preferred term

[(4z,6r,7r,8s,10e,12e,14s,15s,16r)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-yl] (2r)-2-(2-methylpropanoylamino)propanoate  

Type

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

Broader concept

charge

  • 0

formula

  • C33H44N2O8

inchi

  • InChI=1S/C33H44N2O8/c1-18(2)32(39)34-21(5)33(40)43-25-13-8-7-9-14-26-29-27(41-6)17-28(37)35(29)24-16-23(36)15-22(31(24)42-26)12-10-11-19(3)30(38)20(25)4/h7-9,11,14-16,18,20-21,25-27,29-30,36,38H,10,12-13,17H2,1-6H3,(H,34,39)/b8-7+,14-9+,19-11-/t20-,21+,25-,26-,27+,29+,30-/m0/s1

inchikey

  • CSPLOMMYFKCXIH-XUGFZKIUSA-N

mass

  • 596.721

monoisotopicmass

  • 596.30977

smiles

  • O=C1N2C3=C4O[C@H]([C@@H]2[C@@H](C1)OC)C=CC=CC[C@H](OC(=O)[C@H](NC(=O)C(C)C)C)[C@@H]([C@H](C(=CCCC4=CC(=C3)O)C)O)C

subset

  • 2_STAR

synonym EXACT

  • [(4Z,6R,7R,8S,10E,12E,14S,15S,16R)-6,22-dihydroxy-16-methoxy-5,7-dimethyl-18-oxo-25-oxa-19-azatetracyclo[12.9.2.015,19.020,24]pentacosa-1(24),4,10,12,20,22-hexaen-8-yl] (2R)-2-(2-methylpropanoylamino)propanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227431

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