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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > ester > carboxylic ester > benzoate ester > gallate ester > 5,7-dihydroxy-2-/{2,3,4,5-tetrahydroxy-6-oxo-6h-benzo[7]annulen-8-yl/}-3,4-dihydro-2h-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate
... > organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > gallate ester > 5,7-dihydroxy-2-/{2,3,4,5-tetrahydroxy-6-oxo-6h-benzo[7]annulen-8-yl/}-3,4-dihydro-2h-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate

Preferred term

5,7-dihydroxy-2-/{2,3,4,5-tetrahydroxy-6-oxo-6h-benzo[7]annulen-8-yl/}-3,4-dihydro-2h-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate  

Type

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

Broader concept

charge

  • 0

formula

  • C27H20O13

inchi

  • InChI=1S/C27H20O13/c28-12-6-14(29)13-8-20(40-27(38)11-4-15(30)22(34)16(31)5-11)26(39-19(13)7-12)10-1-9-2-18(33)24(36)25(37)21(9)23(35)17(32)3-10/h1-7,20,26,28-31,33-34,36-37H,8H2,(H,32,35)

inchikey

  • CMGRMMSVGCHWOK-UHFFFAOYSA-N

mass

  • 552.444

monoisotopicmass

  • 552.09039

smiles

  • O1C(C(OC(=O)C2=CC(O)=C(O)C(O)=C2)CC=3C1=CC(O)=CC3O)C=4C=C5C(=C(O)C(=O)C4)C(O)=C(O)C(O)=C5

subset

  • 2_STAR

synonym EXACT

  • [5,7-dihydroxy-2-(2,3,4,5-tetrahydroxy-6-oxobenzo[7]annulen-8-yl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184388

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