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Chemistry, part 1

Content language

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Concept information

organooxygen compound > cochliodone f

Preferred term

cochliodone f  

Type

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

Broader concept

charge

  • 0

formula

  • C36H38O14

has_functional_parent

inchi

  • InChI=1S/C36H38O14/c1-19(47-17-37)9-7-11-23-13-25-27(15-45-23)31(41)35(5,49-21(3)39)33(43)29(25)30-26-14-24(12-8-10-20(2)48-18-38)46-16-28(26)32(42)36(6,34(30)44)50-22(4)40/h13-20H,7-12H2,1-6H3/t19?,20?,35-,36+

inchikey

  • YFVMPIKFZVJKTL-MIOBVOACSA-N

mass

  • 694.686

monoisotopicmass

  • 694.22616

smiles

  • O=C1C(C2=C3C(C(=O)[C@](C2=O)(OC(=O)C)C)=COC(=C3)CCCC(OC=O)C)=C4C(=COC(=C4)CCCC(OC=O)C)C([C@@]1(OC(=O)C)C)=O

subset

  • 2_STAR

synonym EXACT

  • [(7S)-5-[(7R)-7-acetyloxy-3-(4-ormyloxypentyl)-7-methyl-6,8-dioxoisochromen-5-yl]-3-(4-ormyloxypentyl)-7-methyl-6,8-dioxoisochromen-7-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214787

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