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Concept information

organooxygen compound > oxacycle > pyrans > pyranone > herpotrichone b

Preferred term

herpotrichone b  

Type

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

Broader concept

charge

  • 0

formula

  • C22H26O7

inchi

  • InChI=1S/C22H26O7/c1-5-6-11-18-14(25-3)9-17(23)28-15(18)7-12-10(2)27-21(26-4)13-8-16-19(29-16)20(24)22(11,12)13/h8-12,16,19,21H,5-7H2,1-4H3/t10-,11-,12-,16+,19+,21+,22+/m0/s1

inchikey

  • XMZRXROVLVZVQL-JOABLRHPSA-N

mass

  • 402.443

monoisotopicmass

  • 402.16785

smiles

  • O=C1OC2=C([C@@H]([C@@]34C(=C[C@@H]5[C@H](C3=O)O5)[C@H](OC)O[C@H]([C@@H]4C2)C)CCC)C(=C1)OC

subset

  • 2_STAR

synonym EXACT

  • (1R,3R,5R,8R,10S,11R,19S)-8,17-dimethoxy-10-methyl-19-propyl-4,9,14-trioxapentacyclo[9.8.0.01,7.03,5.013,18]nonadeca-6,13(18),16-triene-2,15-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216994

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