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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > azamacrocycle > emestrin e
... > 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 > emestrin e
... > 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 > emestrin e
... > 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 > emestrin e
... > 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 > emestrin e
... > organooxygen compound > ester > sulfuric ester > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > emestrin e
... > 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 > emestrin e
... > 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 > emestrin e
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > carbohydrate sulfate > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > emestrin e
... > 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 > emestrin e
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > polysaccharide derivative > aminoglycan > glycosaminoglycan > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > emestrin e
... > 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 > emestrin e
... > chemical entity > molecular entity > polyatomic entity > macromolecule > biomacromolecule > polysaccharide derivative > aminoglycan > glycosaminoglycan > sulfated glycosaminoglycan > keratan sulfate > keratan 6'-sulfate > emestrin e
... > 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 > emestrin e
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > polysaccharide derivative > aminoglycan > glycosaminoglycan > mucopolysaccharide > keratan sulfate > keratan 6'-sulfate > emestrin e
... > 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 > emestrin e
... > chemical entity > molecular entity > polyatomic entity > macromolecule > biomacromolecule > polysaccharide derivative > aminoglycan > glycosaminoglycan > mucopolysaccharide > keratan sulfate > keratan 6'-sulfate > emestrin e

Preferred term

emestrin e  

Type

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

Broader concept

charge

  • 0

formula

  • C28H24N2O10S4

inchi

  • InChI=1S/C28H24N2O10S4/c1-29-25(34)28-23(32)15-12-38-9-8-18-21(15)30(28)26(35)27(29,41-43-44-42-28)22(31)13-4-6-16(36-2)19(10-13)39-20-11-14(24(33)40-18)5-7-17(20)37-3/h4-12,18,21-23,31-32H,1-3H3/t18-,21-,22-,23+,27?,28+/m0/s1

inchikey

  • BSACXXWPBIKXAX-SZEHRFTISA-N

mass

  • 676.740

monoisotopicmass

  • 676.03138

smiles

  • S1SS[C@@]23N4[C@@H]5[C@@H](OC(=O)C=6C=CC(=C(OC=7C=C([C@@H](C(S1)(N(C)C2=O)C4=O)O)C=CC7OC)C6)OC)C=COC=C5[C@H]3O

subset

  • 2_STAR

synonym EXACT

  • (1R,3S,9S,23S,34R)-23,34-dihydroxy-15,19-dimethoxy-30-methyl-6,10,17-trioxa-25,26,27,28-tetrathia-2,30-diazaheptacyclo[22.4.2.11,4.12,24.112,16.118,22.03,9]tetratriaconta-4,7,12(33),13,15,18,20,22(32)-octaene-11,29,31-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216477

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