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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > (-)-(7r,8r,8'r)-4,4'-dihydroxy-3,3',5'-trimethoxy-7,9'-epoxylignan
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > (-)-(7r,8r,8'r)-4,4'-dihydroxy-3,3',5'-trimethoxy-7,9'-epoxylignan
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > (-)-(7r,8r,8'r)-4,4'-dihydroxy-3,3',5'-trimethoxy-7,9'-epoxylignan
... > organooxygen compound > ether > aromatic ether > methoxybenzenes > dimethoxybenzene > (-)-(7r,8r,8'r)-4,4'-dihydroxy-3,3',5'-trimethoxy-7,9'-epoxylignan
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > lignan > (-)-(7r,8r,8'r)-4,4'-dihydroxy-3,3',5'-trimethoxy-7,9'-epoxylignan
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > lignan > (-)-(7r,8r,8'r)-4,4'-dihydroxy-3,3',5'-trimethoxy-7,9'-epoxylignan

Preferred term

(-)-(7r,8r,8'r)-4,4'-dihydroxy-3,3',5'-trimethoxy-7,9'-epoxylignan  

Type

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

charge

  • 0

formula

  • C21H26O6

inchi

  • InChI=1S/C21H26O6/c1-12-15(7-13-8-18(25-3)20(23)19(9-13)26-4)11-27-21(12)14-5-6-16(22)17(10-14)24-2/h5-6,8-10,12,15,21-23H,7,11H2,1-4H3/t12-,15+,21-/m1/s1

inchikey

  • DHWYNFQVHPLJKU-PYDTXJQDSA-N

mass

  • 374.42750

monoisotopicmass

  • 374.17294

smiles

  • COc1cc(ccc1O)[C@@H]1OC[C@H](Cc2cc(OC)c(O)c(OC)c2)[C@H]1C

subset

  • 3_STAR

synonym EXACT

  • 4-{[(3R,4R,5R)-5-(4-hydroxy-3-methoxyphenyl)-4-methyloxolan-3-yl]methyl}-2,6-dimethoxyphenol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68167

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