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Chemistry, part 2

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > [(3s,4s)-6-[(3s)-7-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-10-hydroxy-9-methoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-5-yl]-10-hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-4-yl] acetate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > lignan > [(3s,4s)-6-[(3s)-7-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-10-hydroxy-9-methoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-5-yl]-10-hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-4-yl] acetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > lignan > [(3s,4s)-6-[(3s)-7-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-10-hydroxy-9-methoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-5-yl]-10-hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-4-yl] acetate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > lignan > [(3s,4s)-6-[(3s)-7-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-10-hydroxy-9-methoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-5-yl]-10-hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-4-yl] acetate

Preferred term

[(3s,4s)-6-[(3s)-7-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-10-hydroxy-9-methoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-5-yl]-10-hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromen-4-yl] acetate  

Type

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

Broader concept

charge

  • 0

formula

  • C40H46O15

inchi

  • InChI=1S/C40H46O15/c1-16-8-20-24(14-51-16)34(43)32-22(9-19(10-26(32)47-4)54-40-37(46)36(45)39(50-7)29(13-41)55-40)30(20)31-23-11-21-25(15-52-17(2)38(21)53-18(3)42)35(44)33(23)28(49-6)12-27(31)48-5/h9-12,16-17,29,36-41,43-46H,8,13-15H2,1-7H3/t16-,17-,29?,36?,37?,38+,39?,40?/m0/s1

inchikey

  • WWMFRHLTGLCMDR-QSLBZYNZSA-N

mass

  • 766.793

monoisotopicmass

  • 766.28367

smiles

  • O=C(O[C@H]1C=2C(=C(O)C3=C(OC)C=C(C(=C3C2)C=4C=5C(C(O)=C6C4C[C@H](C)OC6)=C(OC)C=C(C5)OC7OC(C(OC)C(C7O)O)CO)OC)CO[C@H]1C)C

subset

  • 2_STAR

synonym EXACT

  • [(3S,4S)-6-[(3S)-7-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-10-hydroxy-9-methoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromen-5-yl]-10-hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromen-4-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211099

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