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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > ketone > cyclic ketone > quinone > naphthoquinone > (1r,4r,13r,14r,18s)-7,13,18-trihydroxy-17-methyl-19,20-dioxapentacyclo[12.4.1.11,4.04,13.06,11]icosa-6(11),7,9,16-tetraene-5,12,15-trione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > cyclic ketone > quinone > naphthoquinone > (1r,4r,13r,14r,18s)-7,13,18-trihydroxy-17-methyl-19,20-dioxapentacyclo[12.4.1.11,4.04,13.06,11]icosa-6(11),7,9,16-tetraene-5,12,15-trione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > cyclic ketone > quinone > naphthoquinone > (1r,4r,13r,14r,18s)-7,13,18-trihydroxy-17-methyl-19,20-dioxapentacyclo[12.4.1.11,4.04,13.06,11]icosa-6(11),7,9,16-tetraene-5,12,15-trione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > quinone > naphthoquinone > (1r,4r,13r,14r,18s)-7,13,18-trihydroxy-17-methyl-19,20-dioxapentacyclo[12.4.1.11,4.04,13.06,11]icosa-6(11),7,9,16-tetraene-5,12,15-trione
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > quinone > naphthoquinone > (1r,4r,13r,14r,18s)-7,13,18-trihydroxy-17-methyl-19,20-dioxapentacyclo[12.4.1.11,4.04,13.06,11]icosa-6(11),7,9,16-tetraene-5,12,15-trione

Preferred term

(1r,4r,13r,14r,18s)-7,13,18-trihydroxy-17-methyl-19,20-dioxapentacyclo[12.4.1.11,4.04,13.06,11]icosa-6(11),7,9,16-tetraene-5,12,15-trione  

Type

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

Broader concept

charge

  • 0

formula

  • C19H16O8

inchi

  • InChI=1S/C19H16O8/c1-8-7-11(21)16-19(25)14(23)9-3-2-4-10(20)12(9)15(24)17(19)5-6-18(26-16,27-17)13(8)22/h2-4,7,13,16,20,22,25H,5-6H2,1H3/t13-,16-,17-,18+,19+/m0/s1

inchikey

  • SUPQFCHLAKPQDQ-BHWRABCJSA-N

mass

  • 372.329

monoisotopicmass

  • 372.08452

smiles

  • O=C1C=C([C@H](O)[C@@]23O[C@@H]1[C@]4(O)C(=O)C5=C(C(O)=CC=C5)C([C@]4(CC2)O3)=O)C

subset

  • 2_STAR

synonym EXACT

  • (1R,4R,13R,14R,18S)-7,13,18-trihydroxy-17-methyl-19,20-dioxapentacyclo[12.4.1.11,4.04,13.06,11]icosa-6(11),7,9,16-tetraene-5,12,15-trione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207280

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