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Chemistry, part 2

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Concept information

organooxygen compound > oxacycle > dibenzopyran > xanthenes > secalonic acid j
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > dibenzopyran > xanthenes > secalonic acid j
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > dibenzopyran > xanthenes > secalonic acid j
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > dibenzopyran > xanthenes > secalonic acid j
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > dibenzopyran > xanthenes > secalonic acid j
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > dibenzopyran > xanthenes > secalonic acid j
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > dibenzopyran > xanthenes > secalonic acid j

Preferred term

secalonic acid j  

Type

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

Broader concept

charge

  • 0

formula

  • C32H30O14

inchi

  • InChI=1S/C32H30O14/c1-11-10-17-21(27(39)22-14(33)6-8-18(35)31(22,46-17)29(41)43-3)25(37)19(11)13-5-7-16-20(24(13)36)26(38)23-15(34)9-12(2)28(40)32(23,45-16)30(42)44-4/h5,7,10,12,18,28,35-40H,6,8-9H2,1-4H3/t12-,18+,28+,31-,32+/m0/s1

inchikey

  • WIZZCXFBFFCTSY-RYGOELPRSA-N

mass

  • 638.578

monoisotopicmass

  • 638.16356

smiles

  • O=C1C2=C(O)C3=C(O)C(C4=C(O)C=5C(O)=C6C(=O)CC[C@H]([C@]6(C(=O)OC)OC5C=C4C)O)=CC=C3O[C@@]2(C(=O)OC)[C@H](O)[C@H](C1)C

subset

  • 2_STAR

synonym EXACT

  • methyl (4R,4aR)-7-[(5R,6S,10aR)-1,5,9-trihydroxy-10a-methoxycarbonyl-6-methyl-8-oxo-6,7-dihydro-5H-xanthen-2-yl]-4,8,9-trihydroxy-6-methyl-1-oxo-3,4-dihydro-2H-xanthene-4a-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207269

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