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Concept information

Preferred term

پنیسیلازافیلون A  

Type

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

Broader concept

charge

  • 0

formula

  • C22H32O6

inchi

  • InChI=1S/C22H32O6/c1-7-13(2)19-21(5,28-20(3,4)27-19)9-8-15-10-14-11-17(23)22(6,25)18(24)16(14)12-26-15/h8-11,13,16,18-19,24-25H,7,12H2,1-6H3/b9-8+/t13-,16-,18+,19?,21?,22-/m0/s1

inchikey

  • IWEMHAGFVAXHLO-BJFLWUPSSA-N

mass

  • 392.492

monoisotopicmass

  • 392.21989

smiles

  • O=C1C=C2C=C(OC[C@@H]2[C@H]([C@]1(O)C)O)/C=C/C3(OC(C)(C)OC3[C@H](CC)C)C

subset

  • 2_STAR

synonym EXACT

  • (7R,8R,8aR)-3-[(E)-2-[5-[(2S)-butan-2-yl]-2,2,4-trimethyl-1,3-dioxolan-4-yl]ethenyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200313

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