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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > (3s)-8-[(6-o-acetyl-beta-d-glucopyranosyl)oxy]-3-[(1e,3e,5e)-hepta-1,3,5-trienyl]-3,4-dihydro-6-methoxy-5-methyl-1h-2-benzopyran-1-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > (3s)-8-[(6-o-acetyl-beta-d-glucopyranosyl)oxy]-3-[(1e,3e,5e)-hepta-1,3,5-trienyl]-3,4-dihydro-6-methoxy-5-methyl-1h-2-benzopyran-1-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > (3s)-8-[(6-o-acetyl-beta-d-glucopyranosyl)oxy]-3-[(1e,3e,5e)-hepta-1,3,5-trienyl]-3,4-dihydro-6-methoxy-5-methyl-1h-2-benzopyran-1-one

Preferred term

(3s)-8-[(6-o-acetyl-beta-d-glucopyranosyl)oxy]-3-[(1e,3e,5e)-hepta-1,3,5-trienyl]-3,4-dihydro-6-methoxy-5-methyl-1h-2-benzopyran-1-one  

Type

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

Broader concept

charge

  • 0

formula

  • C26H32O10

inchi

  • InChI=1S/C26H32O10/c1-5-6-7-8-9-10-16-11-17-14(2)18(32-4)12-19(21(17)25(31)34-16)35-26-24(30)23(29)22(28)20(36-26)13-33-15(3)27/h5-10,12,16,20,22-24,26,28-30H,11,13H2,1-4H3/b6-5+,8-7+,10-9+/t16-,20-,22-,23+,24-,26-/m1/s1

inchikey

  • HFNVEOAKDZDOHA-FXHUFLIJSA-N

mass

  • 504.532

monoisotopicmass

  • 504.19955

smiles

  • O=C1O[C@H](/C=C/C=C/C=C/C)CC=2C1=C(O[C@@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)O)COC(=O)C)C=C(OC)C2C

subset

  • 2_STAR

synonym EXACT

  • [(2R,3S,4S,5R,6S)-6-[[(3S)-3-[(1E,3E,5E)-hepta-1,3,5-trienyl]-6-methoxy-5-methyl-1-oxo-3,4-dihydroisochromen-8-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197684

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