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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > lignan > austrobailignan 7
... > 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 > austrobailignan 7
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > lignan > austrobailignan 7

Preferred term

austrobailignan 7  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22O5

inchi

  • InChI=1S/C20H22O5/c1-11-12(2)20(14-5-7-16-18(9-14)24-10-23-16)25-19(11)13-4-6-15(21)17(8-13)22-3/h4-9,11-12,19-21H,10H2,1-3H3/t11-,12-,19+,20-/m0/s1

inchikey

  • JPDORDSJPIKURD-UAFHBQARSA-N

mass

  • 342.391

monoisotopicmass

  • 342.14672

smiles

  • O1[C@@H]([C@H]([C@@H]([C@@H]1C2=CC(OC)=C(O)C=C2)C)C)C3=CC=4OCOC4C=C3

subset

  • 2_STAR

synonym EXACT

  • 4-[(2R,3S,4S,5S)-5-(1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-2-methoxyphenol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:175347

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