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Chemistry, part 1

Content language

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Concept information

organic aromatic compound > aromatic ether > mollicellin c
organic heterocyclic compound > organic heteropolycyclic compound > organic heterotricyclic compound > mollicellin c
organooxygen compound > carbonyl compound > aldehyde > mollicellin c
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > polyphenol > mollicellin c
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > polyphenol > mollicellin c
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > polyphenol > mollicellin c
organic aromatic compound > phenols > polyphenol > mollicellin c
organooxygen compound > carbonyl compound > ketone > aromatic ketone > mollicellin c

Preferred term

mollicellin c  

Type

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

Broader concept

charge

  • 0

formula

  • C22H20O8

has_role

inchi

  • InChI=1S/C22H20O8/c1-9(2)6-14(25)16-11(4)18-21(17(26)20(16)28-5)30-22(27)15-10(3)7-13(24)12(8-23)19(15)29-18/h6-8,24,26H,1-5H3

inchikey

  • RPSLZGPKLQLZGH-UHFFFAOYSA-N

mass

  • 412.38940

monoisotopicmass

  • 412.11582

smiles

  • COc1c(O)c2OC(=O)c3c(C)cc(O)c(C=O)c3Oc2c(C)c1C(=O)C=C(C)C

subset

  • 3_STAR

synonym EXACT

  • 3,9-dihydroxy-8-methoxy-1,6-dimethyl-7-(3-methylbut-2-enoyl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-4-carbaldehyde

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68802

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