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

Preferred term

cubebinone  

Type

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

Broader concept

charge

  • 0

formula

  • C23H26O8

inchi

  • InChI=1S/C23H26O8/c1-25-17-7-13(8-18(26-2)21(17)28-4)5-15-11-29-23(24)16(15)6-14-9-19(27-3)22-20(10-14)30-12-31-22/h7-10,15-16H,5-6,11-12H2,1-4H3/t15-,16+/m0/s1

inchikey

  • BFDODNWEBMWJIS-JKSUJKDBSA-N

mass

  • 430.453

monoisotopicmass

  • 430.16277

smiles

  • O1C[C@@H]([C@@H](CC2=CC=3OCOC3C(OC)=C2)C1=O)CC4=CC(OC)=C(OC)C(OC)=C4

subset

  • 2_STAR

synonym EXACT

  • (3R,4R)-3-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191784

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